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726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n+00001310: 6f3c 2f74 6974 6c65 3e0a 3c65 6c6c 6970 o..\n+00001370: 3c74 6578 7420 7465 7874 2d61 6e63 686f file\n+000013d0: 696f 3c2f 7465 7874 3e0a 3c2f 673e 0a3c io..<\n+000013e0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+000013f0: 726f 6d61 6373 5f73 7761 7026 2334 353b romacs_swap-\n+00001400: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+00001410: 726f 6d61 6373 5f66 696c 6569 6f20 2d2d romacs_fileio --\n+00001420: 3e0a 3c67 2069 643d 2265 6467 6532 2220 >..module_src_\n+00001450: 6772 6f6d 6163 735f 7377 6170 2623 3435 gromacs_swap-\n+00001460: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00001470: 6772 6f6d 6163 735f 6669 6c65 696f 3c2f gromacs_fileio.....<\n+000016b0: 6720 6964 3d22 6e6f 6465 3333 2220 636c g id=\"node33\" cl\n+000016c0: 6173 733d 226e 6f64 6522 3e0a 3c74 6974 ass=\"node\">.module_src_gr\n+000016e0: 6f6d 6163 735f 646f 6d64 6563 3c2f 7469 omacs_domdec...<\n+000017b0: 7465 7874 2074 6578 742d 616e 6368 6f72 text text-anchor\n+000017c0: 3d22 6d69 6464 6c65 2220 783d 2231 3934 =\"middle\" x=\"194\n+000017d0: 322e 3536 2220 793d 222d 3436 372e 3033 2.56\" y=\"-467.03\n+000017e0: 2220 666f 6e74 2d66 616d 696c 793d 2246 \" font-family=\"F\n+000017f0: 7265 6553 616e 7322 2066 6f6e 742d 7369 reeSans\" font-si\n+00001800: 7a65 3d22 3130 2e30 3022 3e64 6f6d 6465 ze=\"10.00\">domde\n+00001810: 633c 2f74 6578 743e 0a3c 2f61 3e0a 3c2f c......mo\n+00001890: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000018a0: 5f73 7761 7026 2334 353b 2667 743b 6d6f _swap->mo\n+000018b0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000018c0: 5f64 6f6d 6465 633c 2f74 6974 6c65 3e0a _domdec.\n+000018d0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .<\n+00001a10: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+00001a20: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+00001a30: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+00001a40: 3139 3831 2e37 332c 2d34 3737 2e34 3520 1981.73,-477.45 \n+00001a50: 3139 3731 2e31 342c 2d34 3737 2e38 3420 1971.14,-477.84 \n+00001a60: 3139 3739 2e36 362c 2d34 3834 2e31 3420 1979.66,-484.14 \n+00001a70: 3139 3831 2e37 332c 2d34 3737 2e34 3522 1981.73,-477.45\"\n+00001a80: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />....\n+00001ad0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00001ae0: 6373 5f68 6172 6477 6172 653c 2f74 6974 cs_hardware</tit\n+00001af0: 6c65 3e0a 3c65 6c6c 6970 7365 2066 696c le>.<ellipse fil\n+00001b00: 6c3d 2223 6266 6266 6266 2220 7374 726f l=\"#bfbfbf\" stro\n+00001b10: 6b65 3d22 626c 6163 6b22 2063 783d 2232 ke=\"black\" cx=\"2\n+00001b20: 3236 372e 3536 2220 6379 3d22 2d31 3033 267.56\" cy=\"-103\n+00001b30: 352e 3336 2220 7278 3d22 3339 2e37 2220 5.36\" rx=\"39.7\" \n+00001b40: 7279 3d22 3133 2e33 3722 2f3e 0a3c 7465 ry=\"13.37\"/>.<te\n+00001b50: 7874 2074 6578 742d 616e 6368 6f72 3d22 xt text-anchor=\"\n+00001b60: 6d69 6464 6c65 2220 783d 2232 3236 372e middle\" x=\"2267.\n+00001b70: 3536 2220 793d 222d 3130 3332 2e38 3622 56\" y=\"-1032.86\"\n+00001b80: 2066 6f6e 742d 6661 6d69 6c79 3d22 4672 font-family=\"Fr\n+00001b90: 6565 5361 6e73 2220 666f 6e74 2d73 697a eeSans\" font-siz\n+00001ba0: 653d 2231 302e 3030 223e 6861 7264 7761 e=\"10.00\">hardwa\n+00001bb0: 7265 3c2f 7465 7874 3e0a 3c2f 673e 0a3c re</text>.</g>.<\n+00001bc0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+00001bd0: 726f 6d61 6373 5f6d 6472 756e 7574 696c romacs_mdrunutil\n+00001be0: 6974 7926 2334 353b 2667 743b 6d6f 6475 ity->modu\n+00001bf0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f68 le_src_gromacs_h\n+00001c00: 6172 6477 6172 6520 2d2d 3e0a 3c67 2069 ardware -->.<g i\n+00001c10: 643d 2265 6467 6531 3222 2063 6c61 7373 d=\"edge12\" class\n+00001c20: 3d22 6564 6765 223e 0a3c 7469 746c 653e =\"edge\">.<title>\n+00001c30: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00001c40: 6373 5f6d 6472 756e 7574 696c 6974 7926 cs_mdrunutility&\n+00001c50: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00001c60: 7263 5f67 726f 6d61 6373 5f68 6172 6477 rc_gromacs_hardw\n+00001c70: 6172 653c 2f74 6974 6c65 3e0a 3c70 6174 are......mo\n+00001de0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00001df0: 5f6d 6472 756e 3c2f 7469 746c 653e 0a3c _mdrun.<\n+00001e00: 6720 6964 3d22 615f 6e6f 6465 3139 223e g id=\"a_node19\">\n+00001e10: 3c61 2078 6c69 6e6b 3a68 7265 663d 2267 ..mdrun.\n+00001f20: 3c2f 613e 0a3c 2f67 3e0a 3c2f 673e 0a3c ...<\n+00001f30: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+00001f40: 726f 6d61 6373 5f6d 6472 756e 7574 696c romacs_mdrunutil\n+00001f50: 6974 7926 2334 353b 2667 743b 6d6f 6475 ity->modu\n+00001f60: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+00001f70: 6472 756e 202d 2d3e 0a3c 6720 6964 3d22 drun -->..mod\n+00001fa0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00001fb0: 6d64 7275 6e75 7469 6c69 7479 2623 3435 mdrunutility-\n+00001fc0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00001fd0: 6772 6f6d 6163 735f 6d64 7275 6e3c 2f74 gromacs_mdrun</t\n+00001fe0: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n+00001ff0: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n+00002000: 7265 6422 2064 3d22 4d31 3633 302e 322c red\" d=\"M1630.2,\n+00002010: 2d31 3038 342e 3539 4331 3632 382e 3239 -1084.59C1628.29\n+00002020: 2c2d 3130 3632 2e32 3120 3136 3331 2e35 ,-1062.21 1631.5\n+00002030: 362c 2d31 3031 342e 3134 2031 3633 312e 6,-1014.14 1631.\n+00002040: 3536 2c2d 3937 332e 3439 2031 3633 312e 56,-973.49 1631.\n+00002050: 3536 2c2d 3937 332e 3439 2031 3633 312e 56,-973.49 1631.\n+00002060: 3536 2c2d 3937 332e 3439 2031 3633 312e 56,-973.49 1631.\n+00002070: 3536 2c2d 3930 382e 3632 2031 3633 312e 56,-908.62 1631.\n+00002080: 3536 2c2d 3831 372e 3035 2031 3733 342e 56,-817.05 1734.\n+00002090: 3739 2c2d 3737 382e 3233 2031 3637 362e 79,-778.23 1676.\n+000020a0: 3536 2c2d 3730 372e 3537 2031 3632 332e 56,-707.57 1623.\n+000020b0: 3239 2c2d 3634 322e 3933 2031 3535 352e 29,-642.93 1555.\n+000020c0: 3837 2c2d 3732 352e 3235 2031 3439 312e 87,-725.25 1491.\n+000020d0: 3536 2c2d 3637 312e 3537 2031 3435 382e 56,-671.57 1458.\n+000020e0: 3639 2c2d 3634 342e 3134 2031 3437 322e 69,-644.14 1472.\n+000020f0: 3537 2c2d 3632 312e 3533 2031 3435 362e 57,-621.53 1456.\n+00002100: 3536 2c2d 3538 312e 3833 2031 3435 302e 56,-581.83 1450.\n+00002110: 3038 2c2d 3536 352e 3736 2031 3434 342e 08,-565.76 1444.\n+00002120: 3936 2c2d 3536 322e 3833 2031 3434 312e 96,-562.83 1441.\n+00002130: 3536 2c2d 3534 352e 3833 2031 3433 392e 56,-545.83 1439.\n+00002140: 3232 2c2d 3533 342e 3132 2031 3433 372e 22,-534.12 1437.\n+00002150: 3037 2c2d 3533 302e 3033 2031 3434 312e 07,-530.03 1441.\n+00002160: 3536 2c2d 3531 382e 3936 2031 3434 392e 56,-518.96 1449.\n+00002170: 3935 2c2d 3439 382e 3238 2031 3436 322e 95,-498.28 1462.\n+00002180: 3234 2c2d 3530 302e 3038 2031 3437 362e 24,-500.08 1476.\n+00002190: 3536 2c2d 3438 322e 3936 2031 3439 312e 56,-482.96 1491.\n+000021a0: 382c 2d34 3634 2e37 3420 3135 3037 2e34 8,-464.74 1507.4\n+000021b0: 332c 2d34 3432 2e34 3920 3135 3139 2e36 3,-442.49 1519.6\n+000021c0: 352c 2d34 3236 2e39 3122 2f3e 0a3c 706f 5,-426.91\"/>.<po\n+000021d0: 6c79 676f 6e20 6669 6c6c 3d22 7265 6422 lygon fill=\"red\"\n+000021e0: 2073 7472 6f6b 653d 2272 6564 2220 706f stroke=\"red\" po\n+000021f0: 696e 7473 3d22 3135 3232 2e34 372c 2d34 ints=\"1522.47,-4\n+00002200: 3238 2e39 3820 3135 3236 2e30 362c 2d34 28.98 1526.06,-4\n+00002210: 3139 2e30 3220 3135 3137 2e30 342c 2d34 19.02 1517.04,-4\n+00002220: 3234 2e35 3720 3135 3232 2e34 372c 2d34 24.57 1522.47,-4\n+00002230: 3238 2e39 3822 2f3e 0a3c 2f67 3e0a 3c21 28.98\"/>.</g>.<!\n+00002240: 2d2d 206d 6f64 756c 655f 7372 635f 6772 -- module_src_gr\n+00002250: 6f6d 6163 735f 6d64 7275 6e75 7469 6c69 omacs_mdrunutili\n+00002260: 7479 2623 3435 3b26 6774 3b6d 6f64 756c ty->modul\n+00002270: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n+00002280: 786c 6962 202d 2d3e 0a3c 6720 6964 3d22 xlib -->.<g id=\"\n+00002290: 6564 6765 3131 2220 636c 6173 733d 2265 edge11\" class=\"e\n+000022a0: 6467 6522 3e0a 3c74 6974 6c65 3e6d 6f64 dge\">.<title>mod\n+000022b0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000022c0: 6d64 7275 6e75 7469 6c69 7479 2623 3435 mdrunutility-\n+000022d0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+000022e0: 6772 6f6d 6163 735f 676d 786c 6962 3c2f gromacs_gmxlib</\n+000022f0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+00002300: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+00002310: 2223 6266 6266 6266 2220 643d 224d 3136 \"#bfbfbf\" d=\"M16\n+00002320: 3432 2e35 392c 2d31 3038 342e 3937 4331 42.59,-1084.97C1\n+00002330: 3634 382e 3933 2c2d 3130 3735 2e32 3220 648.93,-1075.22 \n+00002340: 3136 3537 2e39 342c 2d31 3036 312e 3232 1657.94,-1061.22\n+00002350: 2031 3636 352e 3536 2c2d 3130 3438 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45;>module_sr\n+00002440: 635f 6772 6f6d 6163 735f 6d64 7479 7065 c_gromacs_mdtype\n+00002450: 7320 2d2d 3e0a 3c67 2069 643d 2265 6467 s -->.<g id=\"edg\n+00002460: 6537 2220 636c 6173 733d 2265 6467 6522 e7\" class=\"edge\"\n+00002470: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n+00002480: 7372 635f 6772 6f6d 6163 735f 6d64 7275 src_gromacs_mdru\n+00002490: 6e75 7469 6c69 7479 2623 3435 3b26 6774 nutility->\n+000024a0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+000024b0: 6163 735f 6d64 7479 7065 733c 2f74 6974 acs_mdtypes</tit\n+000024c0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n+000024d0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2362 none\" stroke=\"#b\n+000024e0: 6662 6662 6622 2064 3d22 4d31 3635 372e fbfbf\" d=\"M1657.\n+000024f0: 3731 2c2d 3130 3836 2e34 3743 3136 3736 71,-1086.47C1676\n+00002500: 2e35 332c 2d31 3037 372e 3335 2031 3730 .53,-1077.35 170\n+00002510: 332e 352c 2d31 3036 332e 3436 2031 3732 3.5,-1063.46 172\n+00002520: 352e 3536 2c2d 3130 3438 2e37 3920 3137 5.56,-1048.79 17\n+00002530: 3738 2e31 2c2d 3130 3133 2e38 3620 3137 78.1,-1013.86 17\n+00002540: 3833 2e32 362c 2d39 3934 2e33 3520 3138 83.26,-994.35 18\n+00002550: 3335 2e35 362c 2d39 3539 2e30 3520 3138 35.56,-959.05 18\n+00002560: 3533 2e39 382c 2d39 3436 2e36 3220 3138 53.98,-946.62 18\n+00002570: 3735 2e38 362c 2d39 3334 2e35 3720 3138 75.86,-934.57 18\n+00002580: 3933 2e31 392c 2d39 3235 2e35 3922 2f3e 93.19,-925.59\"/>\n+00002590: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .<polygon fill=\"\n+000025a0: 2362 6662 6662 6622 2073 7472 6f6b 653d #bfbfbf\" stroke=\n+000025b0: 2223 6266 6266 6266 2220 706f 696e 7473 \"#bfbfbf\" points\n+000025c0: 3d22 3138 3934 2e39 392c 2d39 3238 2e36 =\"1894.99,-928.6\n+000025d0: 2031 3930 322e 3331 2c2d 3932 302e 3934 1902.31,-920.94\n+000025e0: 2031 3839 312e 3831 2c2d 3932 322e 3337 1891.81,-922.37\n+000025f0: 2031 3839 342e 3939 2c2d 3932 382e 3622 1894.99,-928.6\"\n+00002600: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />.</g>.<!-- mod\n+00002610: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00002620: 6d64 7275 6e75 7469 6c69 7479 2623 3435 mdrunutility-\n+00002630: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00002640: 6772 6f6d 6163 735f 6669 6c65 696f 202d gromacs_fileio -\n+00002650: 2d3e 0a3c 6720 6964 3d22 6564 6765 3922 ->.<g id=\"edge9\"\n+00002660: 2063 6c61 7373 3d22 6564 6765 223e 0a3c class=\"edge\">.<\n+00002670: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+00002680: 5f67 726f 6d61 6373 5f6d 6472 756e 7574 _gromacs_mdrunut\n+00002690: 696c 6974 7926 2334 353b 2667 743b 6d6f ility->mo\n+000026a0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000026b0: 5f66 696c 6569 6f3c 2f74 6974 6c65 3e0a _fileio.\n+000026c0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .....mo\n+000028e0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000028f0: 5f63 6f6d 6d61 6e64 6c69 6e65 3c2f 7469 _commandline</ti\n+00002900: 746c 653e 0a3c 6720 6964 3d22 615f 6e6f tle>.<g id=\"a_no\n+00002910: 6465 3335 223e 3c61 2078 6c69 6e6b 3a68 de35\"><a xlink:h\n+00002920: 7265 663d 2267 726f 7570 5f5f 6d6f 6475 ref=\"group__modu\n+00002930: 6c65 5f5f 636f 6d6d 616e 646c 696e 652e le__commandline.\n+00002940: 7868 746d 6c22 2074 6172 6765 743d 225f xhtml\" target=\"_\n+00002950: 746f 7022 2078 6c69 6e6b 3a74 6974 6c65 top\" xlink:title\n+00002960: 3d22 636f 6d6d 616e 646c 696e 6522 3e0a =\"commandline\">.\n+00002970: 3c65 6c6c 6970 7365 2066 696c 6c3d 2223 <ellipse fill=\"#\n+00002980: 6666 6534 6363 2220 7374 726f 6b65 3d22 ffe4cc\" stroke=\"\n+00002990: 626c 6163 6b22 2063 783d 2231 3335 312e black\" cx=\"1351.\n+000029a0: 3536 2220 6379 3d22 2d37 3231 2e30 3122 56\" cy=\"-721.01\"\n+000029b0: 2072 783d 2235 322e 3135 2220 7279 3d22 rx=\"52.15\" ry=\"\n+000029c0: 3133 2e33 3722 2f3e 0a3c 7465 7874 2074 13.37\"/>.<text t\n+000029d0: 6578 742d 616e 6368 6f72 3d22 6d69 6464 ext-anchor=\"midd\n+000029e0: 6c65 2220 783d 2231 3335 312e 3536 2220 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756e 7574 696c 6974 7926 2334 353b 2667 unutility-&g\n+00002ae0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00002af0: 6d61 6373 5f63 6f6d 6d61 6e64 6c69 6e65 macs_commandline\n+00002b00: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......module_src_grom\n+00002c80: 6163 735f 7261 6e64 6f6d 3c2f 7469 746c acs_random...random......modul\n+00002e10: 655f 7372 635f 6772 6f6d 6163 735f 6770 e_src_gromacs_gp\n+00002e20: 755f 7574 696c 733c 2f74 6974 6c65 3e0a u_utils.\n+00002e30: 3c65 6c6c 6970 7365 2066 696c 6c3d 2223 .gpu_utils...\n+00002f60: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n+00002f70: 7263 5f67 726f 6d61 6373 5f67 7075 5f75 rc_gromacs_gpu_u\n+00002f80: 7469 6c73 2623 3435 3b26 6774 3b6d 6f64 tils->mod\n+00002f90: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00002fa0: 6861 7264 7761 7265 3c2f 7469 746c 653e hardware\n+00002fb0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....\n+000030b0: 0a3c 6720 6964 3d22 6e6f 6465 3130 2220 ..module_src_\n+000030e0: 6772 6f6d 6163 735f 7574 696c 6974 793c gromacs_utility<\n+000030f0: 2f74 6974 6c65 3e0a 3c67 2069 643d 2261 /title>...utility\n+00003220: 0a3c 2f61 3e0a 3c2f 673e 0a3c 2f67 3e0a ....\n+00003230: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..mod\n+000032a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000032b0: 6770 755f 7574 696c 7326 2334 353b 2667 gpu_utils-&g\n+000032c0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+000032d0: 6d61 6373 5f75 7469 6c69 7479 3c2f 7469 macs_utility</ti\n+000032e0: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n+000032f0: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n+00003300: 3263 6363 3238 2220 7374 726f 6b65 2d64 2ccc28\" stroke-d\n+00003310: 6173 6861 7272 6179 3d22 352c 3222 2064 asharray=\"5,2\" d\n+00003320: 3d22 4d32 3235 342e 3134 2c2d 3938 332e =\"M2254.14,-983.\n+00003330: 3036 4332 3237 352e 3833 2c2d 3939 322e 06C2275.83,-992.\n+00003340: 3737 2032 3330 372e 3033 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6974 793c 2f74 6974 6c65 unutility</title\n+00004630: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+00004640: 6e65 2220 7374 726f 6b65 3d22 2332 3832 ne\" stroke=\"#282\n+00004650: 6663 6322 2073 7472 6f6b 652d 6461 7368 fcc\" stroke-dash\n+00004660: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n+00004670: 3231 3632 2e37 372c 2d31 3638 2e35 4332 2162.77,-168.5C2\n+00004680: 3137 322e 3736 2c2d 3138 332e 3437 2032 172.76,-183.47 2\n+00004690: 3139 302e 3232 2c2d 3230 392e 3435 2032 190.22,-209.45 2\n+000046a0: 3230 352e 3536 2c2d 3233 312e 3438 2032 205.56,-231.48 2\n+000046b0: 3232 352e 322c 2d32 3539 2e36 3820 3232 225.2,-259.68 22\n+000046c0: 3238 2e35 322c 2d32 3637 2e39 3920 3232 28.52,-267.99 22\n+000046d0: 3530 2e35 362c 2d32 3934 2e33 3520 3232 50.56,-294.35 22\n+000046e0: 3634 2e38 372c 2d33 3131 2e34 3720 3232 64.87,-311.47 22\n+000046f0: 3731 2e37 322c 2d33 3132 2e38 3420 3232 71.72,-312.84 22\n+00004700: 3835 2e35 362c 2d33 3330 2e33 3520 3233 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src_gromacs_list\n+00005500: 6564 5f66 6f72 6365 7326 2334 353b 2667 ed_forces-&g\n+00005510: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00005520: 6d61 6373 5f6d 6474 7970 6573 202d 2d3e macs_mdtypes -->\n+00005530: 0a3c 6720 6964 3d22 6564 6765 3234 2220 .<g id=\"edge24\" \n+00005540: 636c 6173 733d 2265 6467 6522 3e0a 3c74 class=\"edge\">.<t\n+00005550: 6974 6c65 3e6d 6f64 756c 655f 7372 635f itle>module_src_\n+00005560: 6772 6f6d 6163 735f 6c69 7374 6564 5f66 gromacs_listed_f\n+00005570: 6f72 6365 7326 2334 353b 2667 743b 6d6f orces->mo\n+00005580: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00005590: 5f6d 6474 7970 6573 3c2f 7469 746c 653e _mdtypes\n+000055a0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....\n+00005760: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..m\n+000057d0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+000057e0: 735f 6c69 7374 6564 5f66 6f72 6365 7326 s_listed_forces&\n+000057f0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 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3335 372e 3232 2034.56,-357.22\n+00005a30: 2032 3031 312e 3638 2c2d 3339 302e 3236 2011.68,-390.26\n+00005a40: 2031 3938 332e 3431 2c2d 3432 372e 3437 1983.41,-427.47\n+00005a50: 2031 3936 332e 3938 2c2d 3434 392e 3422 1963.98,-449.4\"\n+00005a60: 2f3e 0a3c 706f 6c79 676f 6e20 6669 6c6c />.<polygon fill\n+00005a70: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+00005a80: 653d 2223 3238 3266 6363 2220 706f 696e e=\"#282fcc\" poin\n+00005a90: 7473 3d22 3139 3631 2e31 372c 2d34 3437 ts=\"1961.17,-447\n+00005aa0: 2e32 3920 3139 3536 2e39 392c 2d34 3537 .29 1956.99,-457\n+00005ab0: 2e30 3220 3139 3636 2e33 332c 2d34 3532 .02 1966.33,-452\n+00005ac0: 2e30 3220 3139 3631 2e31 372c 2d34 3437 .02 1961.17,-447\n+00005ad0: 2e32 3922 2f3e 0a3c 2f67 3e0a 3c21 2d2d .29\"/>.</g>.<!--\n+00005ae0: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n+00005af0: 6163 735f 6c69 6e65 6172 616c 6765 6272 acs_linearalgebr\n+00005b00: 6120 2d2d 3e0a 3c67 2069 643d 226e 6f64 a -->.<g 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font-family=\"Fre\n+00005bf0: 6553 616e 7322 2066 6f6e 742d 7369 7a65 eSans\" font-size\n+00005c00: 3d22 3130 2e30 3022 3e6c 696e 6561 7261 =\"10.00\">lineara\n+00005c10: 6c67 6562 7261 3c2f 7465 7874 3e0a 3c2f lgebra</text>.</\n+00005c20: 673e 0a3c 212d 2d20 6d6f 6475 6c65 5f73 g>.<!-- module_s\n+00005c30: 7263 5f67 726f 6d61 6373 5f75 7469 6c69 rc_gromacs_utili\n+00005c40: 7479 2623 3435 3b26 6774 3b6d 6f64 756c ty->modul\n+00005c50: 655f 7372 635f 6772 6f6d 6163 735f 6770 e_src_gromacs_gp\n+00005c60: 755f 7574 696c 7320 2d2d 3e0a 3c67 2069 u_utils -->.<g i\n+00005c70: 643d 2265 6467 6533 3022 2063 6c61 7373 d=\"edge30\" class\n+00005c80: 3d22 6564 6765 223e 0a3c 7469 746c 653e =\"edge\">.<title>\n+00005c90: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00005ca0: 6373 5f75 7469 6c69 7479 2623 3435 3b26 cs_utility-&\n+00005cb0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00005cc0: 6f6d 6163 735f 6770 755f 7574 696c 733c omacs_gpu_utils<\n+00005cd0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+00005ce0: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+00005cf0: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+00005d00: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n+00005d10: 2220 643d 224d 3233 3332 2e33 332c 2d31 \" d=\"M2332.33,-1\n+00005d20: 3032 362e 3237 4332 3331 312e 3138 2c2d 026.27C2311.18,-\n+00005d30: 3130 3136 2e39 3320 3232 3738 2e39 392c 1016.93 2278.99,\n+00005d40: 2d31 3030 312e 3334 2032 3235 362e 3139 -1001.34 2256.19\n+00005d50: 2c2d 3938 392e 3532 222f 3e0a 3c70 6f6c ,-989.52\"/>.<pol\n+00005d60: 7967 6f6e 2066 696c 6c3d 2223 3238 3266 ygon fill=\"#282f\n+00005d70: 6363 2220 7374 726f 6b65 3d22 2332 3832 cc\" stroke=\"#282\n+00005d80: 6663 6322 2070 6f69 6e74 733d 2232 3235 fcc\" points=\"225\n+00005d90: 372e 3533 2c2d 3938 362e 3237 2032 3234 7.53,-986.27 224\n+00005da0: 372e 3035 2c2d 3938 342e 3731 2032 3235 7.05,-984.71 225\n+00005db0: 342e 3237 2c2d 3939 322e 3436 2032 3235 4.27,-992.46 225\n+00005dc0: 372e 3533 2c2d 3938 362e 3237 222f 3e0a 7.53,-986.27\"/>.\n+00005dd0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 </g>.<!-- module\n+00005de0: 5f73 7263 5f67 726f 6d61 6373 5f63 6f6d _src_gromacs_com\n+00005df0: 7061 7420 2d2d 3e0a 3c67 2069 643d 226e pat -->.<g id=\"n\n+00005e00: 6f64 6532 3722 2063 6c61 7373 3d22 6e6f ode27\" class=\"no\n+00005e10: 6465 223e 0a3c 7469 746c 653e 6d6f 6475 de\">.<title>modu\n+00005e20: 6c65 5f73 7263 5f67 726f 6d61 6373 5f63 le_src_gromacs_c\n+00005e30: 6f6d 7061 743c 2f74 6974 6c65 3e0a 3c65 ompat..compat.\n+00005f00: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...m\n+00005f70: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00005f80: 735f 7574 696c 6974 7926 2334 353b 2667 s_utility-&g\n+00005f90: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00005fa0: 6d61 6373 5f63 6f6d 7061 743c 2f74 6974 macs_compat</tit\n+00005fb0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n+00005fc0: 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c\n+00006190: 6c61 7373 3d22 6e6f 6465 223e 0a3c 7469 lass=\"node\">.<ti\n+000061a0: 746c 653e 6d6f 6475 6c65 5f73 7263 5f67 tle>module_src_g\n+000061b0: 726f 6d61 6373 5f6f 6e6c 696e 6568 656c romacs_onlinehel\n+000061c0: 703c 2f74 6974 6c65 3e0a 3c67 2069 643d p...onlinehe\n+000062f0: 6c70 3c2f 7465 7874 3e0a 3c2f 613e 0a3c lp..<\n+00006300: 2f67 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f /g>...\n+00006350: 3c67 2069 643d 2265 6467 6533 3222 2063 .module_src_g\n+00006380: 726f 6d61 6373 5f6e 626e 786d 2623 3435 romacs_nbnxm-\n+00006390: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+000063a0: 6772 6f6d 6163 735f 6770 755f 7574 696c gromacs_gpu_util\n+000063b0: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s..<\n+000064b0: 706f 6c79 676f 6e20 6669 6c6c 3d22 7265 polygon fill=\"re\n+000064c0: 6422 2073 7472 6f6b 653d 2272 6564 2220 d\" stroke=\"red\" \n+000064d0: 706f 696e 7473 3d22 3232 3733 2e33 382c points=\"2273.38,\n+000064e0: 2d39 3630 2e35 3520 3232 3634 2e31 392c -960.55 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2305.1\n+00006720: 312c 2d31 3031 392e 3831 222f 3e0a 3c2f 1,-1019.81\"/>....module_src_gro\n+000067b0: 6d61 6373 5f6e 626e 786d 2623 3435 3b26 macs_nbnxm-&\n+000067c0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+000067d0: 6f6d 6163 735f 6c69 7374 6564 5f66 6f72 omacs_listed_for\n+000067e0: 6365 733c 2f74 6974 6c65 3e0a 3c70 6174 ces...\n+00006910: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...mod\n+00006980: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00006990: 6e62 6e78 6d26 2334 353b 2667 743b 6d6f nbnxm->mo\n+000069a0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000069b0: 5f67 6d78 6c69 623c 2f74 6974 6c65 3e0a _gmxlib.\n+000069c0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ....\n+00006b70: 3c67 2069 643d 2265 6467 6533 3322 2063 .module_src_g\n+00006ba0: 726f 6d61 6373 5f6e 626e 786d 2623 3435 romacs_nbnxm-\n+00006bb0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00006bc0: 6772 6f6d 6163 735f 6d64 7479 7065 733c gromacs_mdtypes<\n+00006bd0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>....\n+00006db0: 0a3c 6720 6964 3d22 6564 6765 3335 2220 ..module_src_\n+00006de0: 6772 6f6d 6163 735f 6e62 6e78 6d26 2334 gromacs_nbnxm\n+00006df0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+00006e00: 5f67 726f 6d61 6373 5f6d 646c 6962 3c2f _gromacs_mdlib..\n+00006f20: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....mo\n+00006f90: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00006fa0: 5f6e 626e 786d 2623 3435 3b26 6774 3b6d _nbnxm->m\n+00006fb0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00006fc0: 735f 646f 6d64 6563 3c2f 7469 746c 653e s_domdec\n+00006fd0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ......module_src_grom\n+00007180: 6163 735f 6577 616c 643c 2f74 6974 6c65 acs_ewald.\n+000071f0: 0a3c 656c 6c69 7073 6520 6669 6c6c 3d22 ..ewald......module_\n+00007330: 7372 635f 6772 6f6d 6163 735f 6e62 6e78 src_gromacs_nbnx\n+00007340: 6d26 2334 353b 2667 743b 6d6f 6475 6c65 m->module\n+00007350: 5f73 7263 5f67 726f 6d61 6373 5f65 7761 _src_gromacs_ewa\n+00007360: 6c64 3c2f 7469 746c 653e 0a3c 7061 7468 ld...\n+000074c0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...module_\n+00007510: 7372 635f 6772 6f6d 6163 735f 6f70 7469 src_gromacs_opti\n+00007520: 6f6e 733c 2f74 6974 6c65 3e0a 3c67 2069 ons..<\n+00007590: 656c 6c69 7073 6520 6669 6c6c 3d22 2366 ellipse fill=\"#f\n+000075a0: 6665 3463 6322 2073 7472 6f6b 653d 2262 fe4cc\" stroke=\"b\n+000075b0: 6c61 636b 2220 6378 3d22 3132 3536 2e35 lack\" cx=\"1256.5\n+000075c0: 3622 2063 793d 222d 3238 302e 3932 2220 6\" cy=\"-280.92\" \n+000075d0: 7278 3d22 3333 2e38 3822 2072 793d 2231 rx=\"33.88\" ry=\"1\n+000075e0: 332e 3337 222f 3e0a 3c74 6578 7420 7465 3.37\"/>.options......module_\n+000079e0: 7372 635f 6772 6f6d 6163 735f 636f 7272 src_gromacs_corr\n+000079f0: 656c 6174 696f 6e66 756e 6374 696f 6e73 elationfunctions\n+00007a00: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+00007a10: 7372 635f 6772 6f6d 6163 735f 6666 743c src_gromacs_fft<\n+00007a20: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+00007a30: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+00007a40: 3d22 2332 3832 6663 6322 2064 3d22 4d37 =\"#282fcc\" d=\"M7\n+00007a50: 3436 2e34 382c 2d37 3734 2e36 3843 3636 46.48,-774.68C66\n+00007a60: 352e 3339 2c2d 3735 382e 3832 2035 3131 5.39,-758.82 511\n+00007a70: 2e32 342c 2d37 3135 2e35 3620 3434 332e .24,-715.56 443.\n+00007a80: 3536 2c2d 3630 382e 3720 3431 302e 372c 56,-608.7 410.7,\n+00007a90: 2d35 3536 2e38 3120 3434 312e 3536 2c2d -556.81 441.56,-\n+00007aa0: 3533 312e 3934 2034 3431 2e35 362c 2d34 531.94 441.56,-4\n+00007ab0: 3730 2e35 3320 3434 312e 3536 2c2d 3437 70.53 441.56,-47\n+00007ac0: 302e 3533 2034 3431 2e35 362c 2d34 3730 0.53 441.56,-470\n+00007ad0: 2e35 3320 3434 312e 3536 2c2d 3334 322e .53 441.56,-342.\n+00007ae0: 3739 2034 3431 2e35 362c 2d33 3037 2e35 79 441.56,-307.5\n+00007af0: 3720 3434 302e 3333 2c2d 3236 362e 3732 7 440.33,-266.72\n+00007b00: 2034 3339 2e34 352c 2d32 3431 2e38 3922 439.45,-241.89\"\n+00007b10: 2f3e 0a3c 706f 6c79 676f 6e20 6669 6c6c />.<polygon fill\n+00007b20: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+00007b30: 653d 2223 3238 3266 6363 2220 706f 696e e=\"#282fcc\" poin\n+00007b40: 7473 3d22 3434 322e 3934 2c2d 3234 312e ts=\"442.94,-241.\n+00007b50: 3535 2034 3339 2e30 372c 2d32 3331 2e36 55 439.07,-231.6\n+00007b60: 3920 3433 352e 3934 2c2d 3234 312e 3831 9 435.94,-241.81\n+00007b70: 2034 3432 2e39 342c 2d32 3431 2e35 3522 442.94,-241.55\"\n+00007b80: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />.</g>.<!-- mod\n+00007b90: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00007ba0: 636f 7272 656c 6174 696f 6e66 756e 6374 correlationfunct\n+00007bb0: 696f 6e73 2623 3435 3b26 6774 3b6d 6f64 ions->mod\n+00007bc0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00007bd0: 6669 6c65 696f 202d 2d3e 0a3c 6720 6964 fileio -->.<g id\n+00007be0: 3d22 6564 6765 3430 2220 636c 6173 733d =\"edge40\" class=\n+00007bf0: 2265 6467 6522 3e0a 3c74 6974 6c65 3e6d \"edge\">.<title>m\n+00007c00: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00007c10: 735f 636f 7272 656c 6174 696f 6e66 756e s_correlationfun\n+00007c20: 6374 696f 6e73 2623 3435 3b26 6774 3b6d ctions->m\n+00007c30: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00007c40: 735f 6669 6c65 696f 3c2f 7469 746c 653e s_fileio\n+00007c50: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ......module_\n+00007de0: 7372 635f 6772 6f6d 6163 735f 636f 7272 src_gromacs_corr\n+00007df0: 656c 6174 696f 6e66 756e 6374 696f 6e73 elationfunctions\n+00007e00: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+00007e10: 7372 635f 6772 6f6d 6163 735f 636f 6d6d src_gromacs_comm\n+00007e20: 616e 646c 696e 653c 2f74 6974 6c65 3e0a andline.\n+00007e30: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .....\n+00007fa0: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 module_sr\n+00007fb0: 635f 6772 6f6d 6163 735f 6666 7426 2334 c_gromacs_fft\n+00007fc0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+00007fd0: 5f67 726f 6d61 6373 5f67 7075 5f75 7469 _gromacs_gpu_uti\n+00007fe0: 6c73 3c2f 7469 746c 653e 0a3c 7061 7468 ls......mod\n+00008190: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000081a0: 7461 736b 6173 7369 676e 6d65 6e74 3c2f taskassignment</\n+000081b0: 7469 746c 653e 0a3c 6720 6964 3d22 615f title>.<g id=\"a_\n+000081c0: 6e6f 6465 3136 223e 3c61 2078 6c69 6e6b node16\"><a xlink\n+000081d0: 3a68 7265 663d 2267 726f 7570 5f5f 6d6f :href=\"group__mo\n+000081e0: 6475 6c65 5f5f 7461 736b 6173 7369 676e dule__taskassign\n+000081f0: 6d65 6e74 2e78 6874 6d6c 2220 7461 7267 ment.xhtml\" targ\n+00008200: 6574 3d22 5f74 6f70 2220 786c 696e 6b3a et=\"_top\" xlink:\n+00008210: 7469 746c 653d 2274 6173 6b61 7373 6967 title=\"taskassig\n+00008220: 6e6d 656e 7422 3e0a 3c65 6c6c 6970 7365 nment\">.<ellipse\n+00008230: 2066 696c 6c3d 2223 6535 6363 6666 2220 fill=\"#e5ccff\" 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7369 676e 6d65 6e74 2623 3435 3b26 6774 signment->\n+00008330: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+00008340: 6163 735f 6d64 7275 6e75 7469 6c69 7479 acs_mdrunutility\n+00008350: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n+00008360: 3530 2220 636c 6173 733d 2265 6467 6522 50\" class=\"edge\"\n+00008370: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n+00008380: 7372 635f 6772 6f6d 6163 735f 7461 736b src_gromacs_task\n+00008390: 6173 7369 676e 6d65 6e74 2623 3435 3b26 assignment-&\n+000083a0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+000083b0: 6f6d 6163 735f 6d64 7275 6e75 7469 6c69 omacs_mdrunutili\n+000083c0: 7479 3c2f 7469 746c 653e 0a3c 7061 7468 ty..<\n+000084e0: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+000084f0: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+00008500: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+00008510: 3136 3930 2e35 352c 2d31 3039 312e 3135 1690.55,-1091.15\n+00008520: 2031 3638 302e 3732 2c2d 3130 3935 2e31 1680.72,-1095.1\n+00008530: 3220 3136 3930 2e38 372c 2d31 3039 382e 2 1690.87,-1098.\n+00008540: 3135 2031 3639 302e 3535 2c2d 3130 3931 15 1690.55,-1091\n+00008550: 2e31 3522 2f3e 0a3c 2f67 3e0a 3c21 2d2d .15\"/>....\n+000085d0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+000085e0: 6373 5f74 6173 6b61 7373 6967 6e6d 656e cs_taskassignmen\n+000085f0: 7426 2334 353b 2667 743b 6d6f 6475 6c65 t->module\n+00008600: 5f73 7263 5f67 726f 6d61 6373 5f67 7075 _src_gromacs_gpu\n+00008610: 5f75 7469 6c73 3c2f 7469 746c 653e 0a3c _utils.<\n+00008620: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n+00008630: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n+00008640: 2220 7374 726f 6b65 2d64 6173 6861 7272 \" stroke-dasharr\n+00008650: 6179 3d22 352c 3222 2064 3d22 4d31 3838 ay=\"5,2\" d=\"M188\n+00008660: 312e 3936 2c2d 3335 352e 3132 4331 3930 1.96,-355.12C190\n+00008670: 372e 3734 2c2d 3336 332e 3731 2031 3934 7.74,-363.71 194\n+00008680: 332e 3931 2c2d 3337 372e 3131 2031 3937 3.91,-377.11 197\n+00008690: 332e 3536 2c2d 3339 332e 3232 2032 3034 3.56,-393.22 204\n+000086a0: 392e 312c 2d34 3334 2e32 3720 3230 3637 9.1,-434.27 2067\n+000086b0: 2e39 342c 2d34 3530 2e39 3720 3231 3230 .94,-450.97 2120\n+000086c0: 2e35 362c 2d35 3138 2e39 3620 3232 3235 .56,-518.96 2225\n+000086d0: 2e37 322c 2d36 3534 2e38 3420 3232 3331 .72,-654.84 2231\n+000086e0: 2e33 392c 2d38 3737 2e31 3820 3232 3330 .39,-877.18 2230\n+000086f0: 2e32 392c 2d39 3438 2e36 3222 2f3e 0a3c .29,-948.62\"/>.<\n+00008700: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+00008710: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+00008720: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+00008730: 3232 3236 2e37 392c 2d39 3438 2e36 3820 2226.79,-948.68 \n+00008740: 3232 3330 2e30 372c 2d39 3538 2e37 3520 2230.07,-958.75 \n+00008750: 3232 3333 2e37 392c 2d39 3438 2e38 3320 2233.79,-948.83 \n+00008760: 3232 3236 2e37 392c 2d39 3438 2e36 3822 2226.79,-948.68\"\n+00008770: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />....modul\n+000087f0: 655f 7372 635f 6772 6f6d 6163 735f 7461 e_src_gromacs_ta\n+00008800: 736b 6173 7369 676e 6d65 6e74 2623 3435 skassignment-\n+00008810: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00008820: 6772 6f6d 6163 735f 6861 7264 7761 7265 gromacs_hardware\n+00008830: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ....<\n+000089e0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+000089f0: 726f 6d61 6373 5f74 6173 6b61 7373 6967 romacs_taskassig\n+00008a00: 6e6d 656e 7426 2334 353b 2667 743b 6d6f nment->mo\n+00008a10: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00008a20: 5f6c 6973 7465 645f 666f 7263 6573 202d _listed_forces -\n+00008a30: 2d3e 0a3c 6720 6964 3d22 6564 6765 3532 ->..\n+00008a50: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 module_sr\n+00008a60: 635f 6772 6f6d 6163 735f 7461 736b 6173 c_gromacs_taskas\n+00008a70: 7369 676e 6d65 6e74 2623 3435 3b26 6774 signment->\n+00008a80: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+00008a90: 6163 735f 6c69 7374 6564 5f66 6f72 6365 acs_listed_force\n+00008aa0: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s...<\n+00008ba0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.\n+00008bf0: 0a3c 6720 6964 3d22 6564 6765 3439 2220 ..module_src_\n+00008c20: 6772 6f6d 6163 735f 7461 736b 6173 7369 gromacs_taskassi\n+00008c30: 676e 6d65 6e74 2623 3435 3b26 6774 3b6d gnment->m\n+00008c40: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00008c50: 735f 676d 786c 6962 3c2f 7469 746c 653e s_gmxlib\n+00008c60: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ......m\n+00008e10: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00008e20: 735f 7461 736b 6173 7369 676e 6d65 6e74 s_taskassignment\n+00008e30: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+00008e40: 7372 635f 6772 6f6d 6163 735f 6d64 7479 src_gromacs_mdty\n+00008e50: 7065 733c 2f74 6974 6c65 3e0a 3c70 6174 pes......module_src_gro\n-00009010: 6d61 6373 5f73 7761 7026 2334 353b 2667 macs_swap-&g\n-00009020: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00009030: 6d61 6373 5f64 6f6d 6465 633c 2f74 6974 macs_domdec....\n-00009440: 0a3c 6720 6964 3d22 6564 6765 3336 2220 ..module_src_\n-00009470: 6772 6f6d 6163 735f 6770 755f 7574 696c gromacs_gpu_util\n-00009480: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n-00009490: 5f73 7263 5f67 726f 6d61 6373 5f68 6172 _src_gromacs_har\n-000094a0: 6477 6172 653c 2f74 6974 6c65 3e0a 3c70 dware..\n-00009510: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2272 .\n-00009580: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...module_\n-000095d0: 7372 635f 6772 6f6d 6163 735f 7574 696c src_gromacs_util\n-000095e0: 6974 793c 2f74 6974 6c65 3e0a 3c67 2069 ity..<\n-00009650: 656c 6c69 7073 6520 6669 6c6c 3d22 2366 ellipse fill=\"#f\n-00009660: 6665 3463 6322 2073 7472 6f6b 653d 2262 fe4cc\" stroke=\"b\n-00009670: 6c61 636b 2220 6378 3d22 3230 3236 2e35 lack\" cx=\"2026.5\n-00009680: 3622 2063 793d 222d 3834 362e 3735 2220 6\" cy=\"-846.75\" \n-00009690: 7278 3d22 3238 2e30 3722 2072 793d 2231 rx=\"28.07\" ry=\"1\n-000096a0: 332e 3337 222f 3e0a 3c74 6578 7420 7465 3.37\"/>.utility......m\n-00009790: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-000097a0: 735f 6770 755f 7574 696c 7326 2334 353b s_gpu_utils-\n-000097b0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-000097c0: 726f 6d61 6373 5f75 7469 6c69 7479 3c2f romacs_utility</\n-000097d0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-000097e0: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-000097f0: 2223 3263 6363 3238 2220 7374 726f 6b65 \"#2ccc28\" stroke\n-00009800: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n-00009810: 2064 3d22 4d31 3839 302e 3638 2c2d 3739 d=\"M1890.68,-79\n-00009820: 332e 3543 3139 3230 2e36 342c 2d38 3033 3.5C1920.64,-803\n-00009830: 2e38 2031 3936 372e 3535 2c2d 3832 312e .8 1967.55,-821.\n-00009840: 3132 2031 3939 372e 3736 2c2d 3833 322e 12 1997.76,-832.\n-00009850: 3937 222f 3e0a 3c70 6f6c 7967 6f6e 2066 97\"/>.<polygon f\n-00009860: 696c 6c3d 2223 3263 6363 3238 2220 7374 ill=\"#2ccc28\" st\n-00009870: 726f 6b65 3d22 2332 6363 6332 3822 2070 roke=\"#2ccc28\" p\n-00009880: 6f69 6e74 733d 2231 3939 362e 3733 2c2d oints=\"1996.73,-\n-00009890: 3833 362e 3333 2032 3030 372e 3332 2c2d 836.33 2007.32,-\n-000098a0: 3833 362e 3736 2031 3939 392e 3331 2c2d 836.76 1999.31,-\n-000098b0: 3832 392e 3832 2031 3939 362e 3733 2c2d 829.82 1996.73,-\n-000098c0: 3833 362e 3333 222f 3e0a 3c2f 673e 0a3c 836.33\"/>.</g>.<\n-000098d0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-000098e0: 726f 6d61 6373 5f67 7075 5f75 7469 6c73 romacs_gpu_utils\n-000098f0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-00009900: 7372 635f 6772 6f6d 6163 735f 6d64 7479 src_gromacs_mdty\n-00009910: 7065 7320 2d2d 3e0a 3c67 2069 643d 2265 pes -->.<g id=\"e\n-00009920: 6467 6533 3722 2063 6c61 7373 3d22 6564 dge37\" class=\"ed\n-00009930: 6765 223e 0a3c 7469 746c 653e 6d6f 6475 ge\">.<title>modu\n-00009940: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n-00009950: 7075 5f75 7469 6c73 2623 3435 3b26 6774 pu_utils->\n-00009960: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00009970: 6163 735f 6d64 7479 7065 733c 2f74 6974 acs_mdtypes</tit\n-00009980: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-00009990: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n-000099a0: 3832 6663 6322 2073 7472 6f6b 652d 6461 82fcc\" stroke-da\n-000099b0: 7368 6172 7261 793d 2235 2c32 2220 643d sharray=\"5,2\" d=\n-000099c0: 224d 3138 3335 2e37 322c 2d37 3733 2e37 \"M1835.72,-773.7\n-000099d0: 3643 3138 3130 2e33 2c2d 3736 3420 3137 6C1810.3,-764 17\n-000099e0: 3732 2e34 372c 2d37 3438 2e33 3520 3137 72.47,-748.35 17\n-000099f0: 3436 2e31 392c 2d37 3336 2e38 3222 2f3e 46.19,-736.82\"/>\n-00009a00: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .<polygon fill=\"\n-00009a10: 2332 3832 6663 6322 2073 7472 6f6b 653d #282fcc\" stroke=\n-00009a20: 2223 3238 3266 6363 2220 706f 696e 7473 \"#282fcc\" points\n-00009a30: 3d22 3137 3437 2e33 2c2d 3733 332e 3438 =\"1747.3,-733.48\n-00009a40: 2031 3733 362e 3734 2c2d 3733 322e 3632 1736.74,-732.62\n-00009a50: 2031 3734 342e 3436 2c2d 3733 392e 3837 1744.46,-739.87\n-00009a60: 2031 3734 372e 332c 2d37 3333 2e34 3822 1747.3,-733.48\"\n-00009a70: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />.</g>.<!-- mod\n-00009a80: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00009a90: 6d64 7275 6e75 7469 6c69 7479 2623 3435 mdrunutility-\n-00009aa0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00009ab0: 6772 6f6d 6163 735f 6861 7264 7761 7265 gromacs_hardware\n-00009ac0: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n-00009ad0: 3435 2220 636c 6173 733d 2265 6467 6522 45\" class=\"edge\"\n-00009ae0: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n-00009af0: 7372 635f 6772 6f6d 6163 735f 6d64 7275 src_gromacs_mdru\n-00009b00: 6e75 7469 6c69 7479 2623 3435 3b26 6774 nutility->\n-00009b10: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00009b20: 6163 735f 6861 7264 7761 7265 3c2f 7469 acs_hardware</ti\n-00009b30: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-00009b40: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-00009b50: 6266 6266 6266 2220 643d 224d 3135 3230 bfbfbf\" d=\"M1520\n-00009b60: 2e38 312c 2d39 3034 2e31 4331 3539 332e .81,-904.1C1593.\n-00009b70: 3435 2c2d 3839 362e 3334 2031 3734 342e 45,-896.34 1744.\n-00009b80: 3438 2c2d 3837 392e 3433 2031 3837 312e 48,-879.43 1871.\n-00009b90: 3536 2c2d 3836 302e 3138 2031 3837 392e 56,-860.18 1879.\n-00009ba0: 3836 2c2d 3835 382e 3932 2031 3838 382e 86,-858.92 1888.\n-00009bb0: 3639 2c2d 3835 372e 3434 2031 3839 372e 69,-857.44 1897.\n-00009bc0: 3137 2c2d 3835 352e 3935 222f 3e0a 3c70 17,-855.95\"/>.<p\n-00009bd0: 6f6c 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635f itle>module_src_\n-00009cc0: 6772 6f6d 6163 735f 6d64 7275 6e75 7469 gromacs_mdrunuti\n-00009cd0: 6c69 7479 2623 3435 3b26 6774 3b6d 6f64 lity->mod\n-00009ce0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00009cf0: 6d64 7275 6e3c 2f74 6974 6c65 3e0a 3c70 mdrun..\n-00009df0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2272 .\n-00009e60: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...\n-00009ed0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00009ee0: 6373 5f6d 6472 756e 7574 696c 6974 7926 cs_mdrunutility&\n-00009ef0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00009f00: 7263 5f67 726f 6d61 6373 5f67 6d78 6c69 rc_gromacs_gmxli\n-00009f10: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b..\n-0000a080: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ...<\n-0000a270: 6720 6964 3d22 6564 6765 3432 2220 636c g id=\"edge42\" cl\n-0000a280: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.module_src_gr\n-0000a2a0: 6f6d 6163 735f 6d64 7275 6e75 7469 6c69 omacs_mdrunutili\n-0000a2b0: 7479 2623 3435 3b26 6774 3b6d 6f64 756c ty->modul\n-0000a2c0: 655f 7372 635f 6772 6f6d 6163 735f 6669 e_src_gromacs_fi\n-0000a2d0: 6c65 696f 3c2f 7469 746c 653e 0a3c 7061 leio......module_src_grom\n-0000a590: 6163 735f 6d64 7275 6e75 7469 6c69 7479 acs_mdrunutility\n-0000a5a0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-0000a5b0: 7372 635f 6772 6f6d 6163 735f 636f 6d6d src_gromacs_comm\n-0000a5c0: 616e 646c 696e 653c 2f74 6974 6c65 3e0a andline.\n-0000a5d0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .....module_src_grom\n-0000a7c0: 6163 735f 7461 626c 6573 3c2f 7469 746c acs_tables...tables<\n-0000a8f0: 2f74 6578 743e 0a3c 2f61 3e0a 3c2f 673e /text>..\n-0000a900: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....m\n-0000a970: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0000a980: 735f 7461 626c 6573 2623 3435 3b26 6774 s_tables->\n-0000a990: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-0000a9a0: 6163 735f 6d64 7370 616e 3c2f 7469 746c acs_mdspan</titl\n-0000a9b0: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n-0000a9c0: 6f6e 6522 2073 7472 6f6b 653d 2223 3238 one\" stroke=\"#28\n-0000a9d0: 3266 6363 2220 7374 726f 6b65 2d64 6173 2fcc\" stroke-das\n-0000a9e0: 6861 7272 6179 3d22 352c 3222 2064 3d22 harray=\"5,2\" d=\"\n-0000a9f0: 4d32 3430 312e 3935 2c2d 3236 372e 3337 M2401.95,-267.37\n-0000aa00: 4332 3430 372e 3933 2c2d 3233 312e 3637 C2407.93,-231.67\n-0000aa10: 2032 3431 392e 3433 2c2d 3132 382e 3836 2419.43,-128.86\n-0000aa20: 2032 3336 342e 3536 2c2d 3738 2e38 3720 2364.56,-78.87 \n-0000aa30: 3233 3233 2e32 2c2d 3431 2e31 3920 3139 2323.2,-41.19 19\n-0000aa40: 3336 2e32 392c 2d33 322e 3732 2031 3830 36.29,-32.72 180\n-0000aa50: 312e 3536 2c2d 3330 2e39 3122 2f3e 0a3c 1.56,-30.91\"/>.<\n-0000aa60: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n-0000aa70: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n-0000aa80: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n-0000aa90: 3138 3031 2e36 2c2d 3237 2e34 3120 3137 1801.6,-27.41 17\n-0000aaa0: 3931 2e35 352c 2d33 302e 3738 2031 3830 91.55,-30.78 180\n-0000aab0: 312e 3531 2c2d 3334 2e34 3120 3138 3031 1.51,-34.41 1801\n-0000aac0: 2e36 2c2d 3237 2e34 3122 2f3e 0a3c 2f67 .6,-27.41\"/>.</g\n-0000aad0: 3e0a 3c21 2d2d 206d 6f64 756c 655f 7372 >.<!-- module_sr\n-0000aae0: 635f 6772 6f6d 6163 735f 7461 626c 6573 c_gromacs_tables\n-0000aaf0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-0000ab00: 7372 635f 6772 6f6d 6163 735f 6d64 7479 src_gromacs_mdty\n-0000ab10: 7065 7320 2d2d 3e0a 3c67 2069 643d 2265 pes -->.<g id=\"e\n-0000ab20: 6467 6534 3822 2063 6c61 7373 3d22 6564 dge48\" class=\"ed\n-0000ab30: 6765 223e 0a3c 7469 746c 653e 6d6f 6475 ge\">.<title>modu\n-0000ab40: 6c65 5f73 7263 5f67 726f 6d61 6373 5f74 le_src_gromacs_t\n-0000ab50: 6162 6c65 7326 2334 353b 2667 743b 6d6f ables->mo\n-0000ab60: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0000ab70: 5f6d 6474 7970 6573 3c2f 7469 746c 653e _mdtypes\n-0000ab80: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....<\n-0000ad20: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-0000ad30: 726f 6d61 6373 5f74 6162 6c65 7326 2334 romacs_tables\n-0000ad40: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0000ad50: 5f67 726f 6d61 6373 5f66 696c 6569 6f20 _gromacs_fileio \n-0000ad60: 2d2d 3e0a 3c67 2069 643d 2265 6467 6534 -->.\n-0000ad80: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n-0000ad90: 7263 5f67 726f 6d61 6373 5f74 6162 6c65 rc_gromacs_table\n-0000ada0: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n-0000adb0: 5f73 7263 5f67 726f 6d61 6373 5f66 696c _src_gromacs_fil\n-0000adc0: 6569 6f3c 2f74 6974 6c65 3e0a 3c70 6174 eio.....\n-0000b0f0: 3c67 2069 643d 2265 6467 6535 3422 2063 .module_src_g\n-0000b120: 726f 6d61 6373 5f6c 6973 7465 645f 666f romacs_listed_fo\n-0000b130: 7263 6573 2623 3435 3b26 6774 3b6d 6f64 rces->mod\n-0000b140: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0000b150: 6770 755f 7574 696c 733c 2f74 6974 6c65 gpu_utils......m\n-0000b2e0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0000b2f0: 735f 6c69 7374 6564 5f66 6f72 6365 7326 s_listed_forces&\n-0000b300: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-0000b310: 7263 5f67 726f 6d61 6373 5f6d 6472 756e rc_gromacs_mdrun\n-0000b320: 7574 696c 6974 793c 2f74 6974 6c65 3e0a utility.\n-0000b330: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .\n-0000b440: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_\n-0000b530: 7372 635f 6772 6f6d 6163 735f 6c69 7374 src_gromacs_list\n-0000b540: 6564 5f66 6f72 6365 7326 2334 353b 2667 ed_forces-&g\n-0000b550: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-0000b560: 6d61 6373 5f74 6162 6c65 733c 2f74 6974 macs_tables</tit\n-0000b570: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-0000b580: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n-0000b590: 3832 6663 6322 2073 7472 6f6b 652d 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module_src_grom\n-0000b680: 6163 735f 6c69 7374 6564 5f66 6f72 6365 acs_listed_force\n-0000b690: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n-0000b6a0: 5f73 7263 5f67 726f 6d61 6373 5f68 6172 _src_gromacs_har\n-0000b6b0: 6477 6172 6520 2d2d 3e0a 3c67 2069 643d dware -->.<g id=\n-0000b6c0: 2265 6467 6535 3722 2063 6c61 7373 3d22 \"edge57\" class=\"\n-0000b6d0: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n-0000b6e0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0000b6f0: 5f6c 6973 7465 645f 666f 7263 6573 2623 _listed_forces&#\n-0000b700: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-0000b710: 635f 6772 6f6d 6163 735f 6861 7264 7761 c_gromacs_hardwa\n-0000b720: 7265 3c2f 7469 746c 653e 0a3c 7061 7468 re..\n-0000b820: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2272 .\n-0000b890: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...\n-0000b900: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-0000b910: 6373 5f6c 6973 7465 645f 666f 7263 6573 cs_listed_forces\n-0000b920: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-0000b930: 7372 635f 6772 6f6d 6163 735f 6e62 6e78 src_gromacs_nbnx\n-0000b940: 6d3c 2f74 6974 6c65 3e0a 3c70 6174 6820 m..<\n-0000b9b0: 706f 6c79 676f 6e20 6669 6c6c 3d22 7265 polygon fill=\"re\n-0000b9c0: 6422 2073 7472 6f6b 653d 2272 6564 2220 d\" stroke=\"red\" \n-0000b9d0: 706f 696e 7473 3d22 3230 3637 2e36 2c2d points=\"2067.6,-\n-0000b9e0: 3239 382e 3436 2032 3035 372e 3938 2c2d 298.46 2057.98,-\n-0000b9f0: 3239 342e 3033 2032 3036 322e 3734 2c2d 294.03 2062.74,-\n-0000ba00: 3330 332e 3439 2032 3036 372e 362c 2d32 303.49 2067.6,-2\n-0000ba10: 3938 2e34 3622 2f3e 0a3c 2f67 3e0a 3c21 98.46\"/>....mo\n-0000ba90: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0000baa0: 5f6c 6973 7465 645f 666f 7263 6573 2623 _listed_forces&#\n-0000bab0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-0000bac0: 635f 6772 6f6d 6163 735f 676d 786c 6962 c_gromacs_gmxlib\n-0000bad0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 .\n-0000bba0: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....modul\n-0000bc90: 655f 7372 635f 6772 6f6d 6163 735f 6c69 e_src_gromacs_li\n-0000bca0: 7374 6564 5f66 6f72 6365 7326 2334 353b sted_forces-\n-0000bcb0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0000bcc0: 726f 6d61 6373 5f6d 6474 7970 6573 3c2f romacs_mdtypes</\n-0000bcd0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-0000bce0: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-0000bcf0: 2272 6564 2220 643d 224d 3231 3137 2e36 \"red\" d=\"M2117.6\n-0000bd00: 352c 2d33 3537 2e34 3943 3231 3131 2e39 5,-357.49C2111.9\n-0000bd10: 382c 2d33 3931 2e35 2032 3039 322e 3438 8,-391.5 2092.48\n-0000bd20: 2c2d 3438 362e 3036 2032 3034 332e 3536 ,-486.06 2043.56\n-0000bd30: 2c2d 3534 352e 3833 2031 3936 362e 3634 ,-545.83 1966.64\n-0000bd40: 2c2d 3633 392e 3831 2031 3832 352e 3331 ,-639.81 1825.31\n-0000bd50: 2c2d 3638 392e 3931 2031 3735 362e 3432 ,-689.91 1756.42\n-0000bd60: 2c2d 3730 392e 3733 222f 3e0a 3c70 6f6c ,-709.73\"/>.<pol\n-0000bd70: 7967 6f6e 2066 696c 6c3d 2272 6564 2220 ygon fill=\"red\" \n-0000bd80: 7374 726f 6b65 3d22 7265 6422 2070 6f69 stroke=\"red\" poi\n-0000bd90: 6e74 733d 2231 3735 352e 3038 2c2d 3730 nts=\"1755.08,-70\n-0000bda0: 362e 3437 2031 3734 362e 342c 2d37 3132 6.47 1746.4,-712\n-0000bdb0: 2e35 3520 3137 3536 2e39 382c 2d37 3133 .55 1756.98,-713\n-0000bdc0: 2e32 3120 3137 3535 2e30 382c 2d37 3036 .21 1755.08,-706\n-0000bdd0: 2e34 3722 2f3e 0a3c 2f67 3e0a 3c21 2d2d .47\"/>.</g>.<!--\n-0000bde0: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n-0000bdf0: 6163 735f 6c69 7374 6564 5f66 6f72 6365 acs_listed_force\n-0000be00: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n-0000be10: 5f73 7263 5f67 726f 6d61 6373 5f6d 646c _src_gromacs_mdl\n-0000be20: 6962 202d 2d3e 0a3c 6720 6964 3d22 6564 ib -->.<g id=\"ed\n-0000be30: 6765 3535 2220 636c 6173 733d 2265 6467 ge55\" class=\"edg\n-0000be40: 6522 3e0a 3c74 6974 6c65 3e6d 6f64 756c e\">.<title>modul\n-0000be50: 655f 7372 635f 6772 6f6d 6163 735f 6c69 e_src_gromacs_li\n-0000be60: 7374 6564 5f66 6f72 6365 7326 2334 353b sted_forces-\n-0000be70: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0000be80: 726f 6d61 6373 5f6d 646c 6962 3c2f 7469 romacs_mdlib</ti\n-0000be90: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-0000bea0: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-0000beb0: 6266 6266 6266 2220 643d 224d 3231 3230 bfbfbf\" d=\"M2120\n-0000bec0: 2e33 322c 2d33 3537 2e33 3143 3231 3136 .32,-357.31C2116\n-0000bed0: 2e31 372c 2d33 3732 2e32 3620 3231 3034 .17,-372.26 2104\n-0000bee0: 2e35 352c 2d33 3938 2032 3039 342e 3536 .55,-398 2094.56\n-0000bef0: 2c2d 3432 302e 3039 2032 3036 392e 3237 ,-420.09 2069.27\n-0000bf00: 2c2d 3437 352e 3939 2032 3037 382e 3837 ,-475.99 2078.87\n-0000bf10: 2c2d 3530 302e 3436 2032 3033 372e 3536 ,-500.46 2037.56\n-0000bf20: 2c2d 3534 352e 3833 2031 3939 392e 3635 ,-545.83 1999.65\n-0000bf30: 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735f 6c69 7374 src_gromacs_list\n-0000c020: 6564 5f66 6f72 6365 7326 2334 353b 2667 ed_forces-&g\n-0000c030: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-0000c040: 6d61 6373 5f64 6f6d 6465 6320 2d2d 3e0a macs_domdec -->.\n-0000c050: 3c67 2069 643d 2265 6467 6535 3022 2063 <g id=\"edge50\" c\n-0000c060: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.<ti\n-0000c070: 746c 653e 6d6f 6475 6c65 5f73 7263 5f67 tle>module_src_g\n-0000c080: 726f 6d61 6373 5f6c 6973 7465 645f 666f romacs_listed_fo\n-0000c090: 7263 6573 2623 3435 3b26 6774 3b6d 6f64 rces->mod\n-0000c0a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0000c0b0: 646f 6d64 6563 3c2f 7469 746c 653e 0a3c domdec.<\n-0000c0c0: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-0000c0d0: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n-0000c0e0: 2220 7374 726f 6b65 2d64 6173 6861 7272 \" stroke-dasharr\n-0000c0f0: 6179 3d22 352c 3222 2064 3d22 4d32 3131 ay=\"5,2\" d=\"M211\n-0000c100: 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45;>module_sr\n-0000c360: 635f 6772 6f6d 6163 735f 6770 755f 7574 c_gromacs_gpu_ut\n-0000c370: 696c 7320 2d2d 3e0a 3c67 2069 643d 2265 ils -->..modu\n-0000c3a0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f75 le_src_gromacs_u\n-0000c3b0: 7469 6c69 7479 2623 3435 3b26 6774 3b6d tility->m\n-0000c3c0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0000c3d0: 735f 6770 755f 7574 696c 733c 2f74 6974 s_gpu_utils</tit\n-0000c3e0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-0000c3f0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n-0000c400: 3832 6663 6322 2073 7472 6f6b 652d 6461 82fcc\" stroke-da\n-0000c410: 7368 6172 7261 793d 2235 2c32 2220 643d sharray=\"5,2\" d=\n-0000c420: 224d 3230 3033 2e36 2c2d 3833 382e 3838 \"M2003.6,-838.88\n-0000c430: 4331 3937 342e 3936 2c2d 3832 392e 3139 C1974.96,-829.19\n-0000c440: 2031 3932 362e 3237 2c2d 3831 312e 3238 1926.27,-811.28\n-0000c450: 2031 3839 342e 3137 2c2d 3739 382e 3735 1894.17,-798.75\n-0000c460: 222f 3e0a 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title>module_src\n-0000c550: 5f67 726f 6d61 6373 5f75 7469 6c69 7479 _gromacs_utility\n-0000c560: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-0000c570: 7372 635f 6772 6f6d 6163 735f 636f 6d70 src_gromacs_comp\n-0000c580: 6174 3c2f 7469 746c 653e 0a3c 7061 7468 at...\n-0000c6c0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...\n-0000c730: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-0000c740: 6373 5f6e 626e 786d 2623 3435 3b26 6774 cs_nbnxm->\n-0000c750: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-0000c760: 6163 735f 6770 755f 7574 696c 733c 2f74 acs_gpu_utils</t\n-0000c770: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n-0000c780: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n-0000c790: 7265 6422 2064 3d22 4d32 3037 352e 3636 red\" d=\"M2075.66\n-0000c7a0: 2c2d 3238 392e 3139 4332 3131 342e 3431 ,-289.19C2114.41\n-0000c7b0: 2c2d 3330 302e 3233 2032 3138 332e 3338 ,-300.23 2183.38\n-0000c7c0: 2c2d 3332 302e 3934 2032 3139 302e 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2c2d 829.32 1965.56,-\n-0000ca60: 3833 362e 3232 2031 3937 362e 3134 2c2d 836.22 1976.14,-\n-0000ca70: 3833 352e 3835 2031 3937 332e 362c 2d38 835.85 1973.6,-8\n-0000ca80: 3239 2e33 3222 2f3e 0a3c 2f67 3e0a 3c21 29.32\"/>....mod\n-0000cb00: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0000cb10: 6e62 6e78 6d26 2334 353b 2667 743b 6d6f nbnxm->mo\n-0000cb20: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0000cb30: 5f6c 6973 7465 645f 666f 7263 6573 3c2f _listed_forces</\n-0000cb40: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-0000cb50: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-0000cb60: 2223 3238 3266 6363 2220 7374 726f 6b65 \"#282fcc\" stroke\n-0000cb70: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n-0000cb80: 2064 3d22 4d32 3036 362e 3835 2c2d 3239 d=\"M2066.85,-29\n-0000cb90: 322e 3339 4332 3037 382e 3136 2c2d 3330 2.39C2078.16,-30\n-0000cba0: 302e 3920 3230 3932 2e35 392c 2d33 3133 0.9 2092.59,-313\n-0000cbb0: 2e31 3320 3231 3033 2e36 312c 2d33 3233 .13 2103.61,-323\n-0000cbc0: 2e34 3122 2f3e 0a3c 706f 6c79 676f 6e20 .41\"/>.<polygon \n-0000cbd0: 6669 6c6c 3d22 2332 3832 6663 6322 2073 fill=\"#282fcc\" s\n-0000cbe0: 7472 6f6b 653d 2223 3238 3266 6363 2220 troke=\"#282fcc\" \n-0000cbf0: 706f 696e 7473 3d22 3231 3031 2e33 312c points=\"2101.31,\n-0000cc00: 2d33 3236 2e30 3520 3231 3130 2e39 342c -326.05 2110.94,\n-0000cc10: 2d33 3330 2e34 3720 3231 3036 2e31 372c -330.47 2106.17,\n-0000cc20: 2d33 3231 2e30 3120 3231 3031 2e33 312c -321.01 2101.31,\n-0000cc30: 2d33 3236 2e30 3522 2f3e 0a3c 2f67 3e0a -326.05\"/>.</g>.\n-0000cc40: 3c21 2d2d 206d 6f64 756c 655f 7372 635f <!-- module_src_\n-0000cc50: 6772 6f6d 6163 735f 6e62 6e78 6d26 2334 gromacs_nbnxm\n-0000cc60: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0000cc70: 5f67 726f 6d61 6373 5f67 6d78 6c69 6220 _gromacs_gmxlib \n-0000cc80: 2d2d 3e0a 3c67 2069 643d 2265 6467 6536 -->.<g id=\"edge6\n-0000cc90: 3322 2063 6c61 7373 3d22 6564 6765 223e 3\" class=\"edge\">\n-0000cca0: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n-0000ccb0: 7263 5f67 726f 6d61 6373 5f6e 626e 786d rc_gromacs_nbnxm\n-0000ccc0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-0000ccd0: 7372 635f 6772 6f6d 6163 735f 676d 786c src_gromacs_gmxl\n-0000cce0: 6962 3c2f 7469 746c 653e 0a3c 7061 7468 ib..\n-0000cd80: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_src_gro\n-0000ce70: 6d61 6373 5f6e 626e 786d 2623 3435 3b26 macs_nbnxm-&\n-0000ce80: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0000ce90: 6f6d 6163 735f 6d64 7479 7065 733c 2f74 omacs_mdtypes......module_src_grom\n-0000d080: 6163 735f 6e62 6e78 6d26 2334 353b 2667 acs_nbnxm-&g\n-0000d090: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-0000d0a0: 6d61 6373 5f6d 646c 6962 3c2f 7469 746c macs_mdlib...\n-0000d1c0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...mod\n-0000d230: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0000d240: 6e62 6e78 6d26 2334 353b 2667 743b 6d6f nbnxm->mo\n-0000d250: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0000d260: 5f64 6f6d 6465 633c 2f74 6974 6c65 3e0a _domdec.\n-0000d270: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 \n-0000d320: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....mo\n-0000d400: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0000d410: 5f6e 626e 786d 2623 3435 3b26 6774 3b6d _nbnxm->m\n-0000d420: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0000d430: 735f 6577 616c 643c 2f74 6974 6c65 3e0a s_ewald.\n-0000d440: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .<\n-0000d520: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n-0000d530: 6363 6332 3822 2073 7472 6f6b 653d 2223 ccc28\" stroke=\"#\n-0000d540: 3263 6363 3238 2220 706f 696e 7473 3d22 2ccc28\" points=\"\n-0000d550: 3136 3630 2e32 362c 2d35 3832 2e39 2031 1660.26,-582.9 1\n-0000d560: 3635 312e 3436 2c2d 3538 382e 3831 2031 651.46,-588.81 1\n-0000d570: 3636 322e 3032 2c2d 3538 392e 3638 2031 662.02,-589.68 1\n-0000d580: 3636 302e 3236 2c2d 3538 322e 3922 2f3e 660.26,-582.9\"/>\n-0000d590: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....modul\n-0000d5f0: 655f 7372 635f 6772 6f6d 6163 735f 636f e_src_gromacs_co\n-0000d600: 7272 656c 6174 696f 6e66 756e 6374 696f rrelationfunctio\n-0000d610: 6e73 3c2f 7469 746c 653e 0a3c 6720 6964 ns...\n-0000d6f0: 3c74 6578 7420 7465 7874 2d61 6e63 686f corre\n-0000d750: 6c61 7469 6f6e 6675 6e63 7469 6f6e 733c lationfunctions<\n-0000d760: 2f74 6578 743e 0a3c 2f61 3e0a 3c2f 673e /text>..\n-0000d770: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module\n-0000d7c0: 5f73 7263 5f67 726f 6d61 6373 5f66 6674 _src_gromacs_fft\n-0000d7d0: 3c2f 7469 746c 653e 0a3c 656c 6c69 7073 ..fft....modul\n-0000d910: 655f 7372 635f 6772 6f6d 6163 735f 636f e_src_gromacs_co\n-0000d920: 7272 656c 6174 696f 6e66 756e 6374 696f rrelationfunctio\n-0000d930: 6e73 2623 3435 3b26 6774 3b6d 6f64 756c ns->modul\n-0000d940: 655f 7372 635f 6772 6f6d 6163 735f 6666 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d=\"M1539.41,-2\n-0000e330: 3034 2e37 3343 3135 3536 2e35 352c 2d31 04.73C1556.55,-1\n-0000e340: 3833 2e33 3120 3135 3931 2e39 382c 2d31 83.31 1591.98,-1\n-0000e350: 3339 2e30 3220 3136 3132 2e36 342c 2d31 39.02 1612.64,-1\n-0000e360: 3133 2e32 222f 3e0a 3c70 6f6c 7967 6f6e 13.2\"/>...<\n-0000e3e0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-0000e3f0: 726f 6d61 6373 5f74 696d 696e 6720 2d2d romacs_timing --\n-0000e400: 3e0a 3c67 2069 643d 226e 6f64 6532 3422 >..<\n-0000e420: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-0000e430: 5f67 726f 6d61 6373 5f74 696d 696e 673c _gromacs_timing<\n-0000e440: 2f74 6974 6c65 3e0a 3c65 6c6c 6970 7365 /title>.\n-0000e4a0: 0a3c 7465 7874 2074 6578 742d 616e 6368 .tim\n-0000e500: 696e 673c 2f74 6578 743e 0a3c 2f67 3e0a ing..\n-0000e510: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module\n-0000e580: 5f73 7263 5f67 726f 6d61 6373 5f74 696d _src_gromacs_tim\n-0000e590: 696e 6726 2334 353b 2667 743b 6d6f 6475 ing->modu\n-0000e5a0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n-0000e5b0: 6474 7970 6573 3c2f 7469 746c 653e 0a3c dtypes.<\n-0000e5c0: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-0000e5d0: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n-0000e5e0: 2220 643d 224d 3137 3134 2e39 372c 2d37 \" d=\"M1714.97,-7\n-0000e5f0: 3730 2e32 3643 3137 3135 2e32 322c 2d37 70.26C1715.22,-7\n-0000e600: 3632 2e39 3220 3137 3135 2e35 332c 2d37 62.92 1715.53,-7\n-0000e610: 3533 2e34 3320 3137 3135 2e38 312c 2d37 53.43 1715.81,-7\n-0000e620: 3434 2e38 3222 2f3e 0a3c 706f 6c79 676f 44.82\"/>..\n-0000e6a0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ..<\n-0000e6f0: 6720 6964 3d22 6564 6765 3934 2220 636c g id=\"edge94\" cl\n-0000e700: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.module_src_gr\n-0000e720: 6f6d 6163 735f 6d64 7275 6e26 2334 353b omacs_mdrun-\n-0000e730: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0000e740: 726f 6d61 6373 5f6d 6f64 756c 6172 7369 romacs_modularsi\n-0000e750: 6d75 6c61 746f 723c 2f74 6974 6c65 3e0a mulator.\n-0000e760: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ....<\n-0000e910: 6720 6964 3d22 6564 6765 3931 2220 636c g id=\"edge91\" cl\n-0000e920: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.module_src_gr\n-0000e940: 6f6d 6163 735f 6d64 7275 6e26 2334 353b omacs_mdrun-\n-0000e950: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0000e960: 726f 6d61 6373 5f70 756c 6c69 6e67 3c2f romacs_pulling.....\n-0000eb40: 3c67 2069 643d 2265 6467 6538 3022 2063 .module_src_g\n-0000eb70: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n-0000eb80: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-0000eb90: 6772 6f6d 6163 735f 7377 6170 3c2f 7469 gromacs_swap......module_\n-0000ed10: 7372 635f 6772 6f6d 6163 735f 6d64 7275 src_gromacs_mdru\n-0000ed20: 6e26 2334 353b 2667 743b 6d6f 6475 6c65 n->module\n-0000ed30: 5f73 7263 5f67 726f 6d61 6373 5f67 7075 _src_gromacs_gpu\n-0000ed40: 5f75 7469 6c73 3c2f 7469 746c 653e 0a3c _utils.<\n-0000ed50: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-0000ed60: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n-0000ed70: 2220 7374 726f 6b65 2d64 6173 6861 7272 \" stroke-dasharr\n-0000ed80: 6179 3d22 352c 3222 2064 3d22 4d31 3534 ay=\"5,2\" d=\"M154\n-0000ed90: 312e 3936 2c2d 3437 382e 3631 4331 3538 1.96,-478.61C158\n-0000eda0: 312e 3737 2c2d 3439 322e 3336 2031 3635 1.77,-492.36 165\n-0000edb0: 382e 3431 2c2d 3531 382e 3835 2031 3635 8.41,-518.85 165\n-0000edc0: 382e 3536 2c2d 3531 382e 3936 2031 3735 8.56,-518.96 175\n-0000edd0: 332e 3336 2c2d 3538 372e 3036 2031 3832 3.36,-587.06 182\n-0000ede0: 352e 3334 2c2d 3731 312e 3533 2031 3835 5.34,-711.53 185\n-0000edf0: 312e 3637 2c2d 3736 312e 3339 222f 3e0a 1.67,-761.39\"/>.\n-0000ee00: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ..\n-0000eec0: 0a3c 6720 6964 3d22 6564 6765 3737 2220 ..module_src_\n-0000eef0: 6772 6f6d 6163 735f 6d64 7275 6e26 2334 gromacs_mdrun\n-0000ef00: 353b 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e_src_gromacs_im\n-0000fce0: 643c 2f74 6974 6c65 3e0a 3c70 6174 6820 d......module_src_grom\n-0000fe40: 6163 735f 6170 706c 6965 645f 666f 7263 acs_applied_forc\n-0000fe50: 6573 3c2f 7469 746c 653e 0a3c 656c 6c69 es..\n-0000ff10: 6170 706c 6965 645f 666f 7263 6573 3c2f applied_forces....modul\n-0000ffa0: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n-0000ffb0: 7275 6e26 2334 353b 2667 743b 6d6f 6475 run->modu\n-0000ffc0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f61 le_src_gromacs_a\n-0000ffd0: 7070 6c69 6564 5f66 6f72 6365 733c 2f74 pplied_forces</t\n-0000ffe0: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n-0000fff0: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n-00010000: 7265 6422 2064 3d22 4d31 3439 322e 3636 red\" d=\"M1492.66\n-00010010: 2c2d 3436 322e 3031 4331 3435 322e 3238 ,-462.01C1452.28\n-00010020: 2c2d 3435 312e 3835 2031 3337 332e 3732 ,-451.85 1373.72\n-00010030: 2c2d 3433 322e 3039 2031 3332 332e 3237 ,-432.09 1323.27\n-00010040: 2c2d 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7263 5f67 tle>module_src_g\n-00010130: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n-00010140: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00010150: 6772 6f6d 6163 735f 676d 786c 6962 3c2f gromacs_gmxlib</\n-00010160: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-00010170: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-00010180: 2223 6266 6266 6266 2220 643d 224d 3135 \"#bfbfbf\" d=\"M15\n-00010190: 3037 2e34 332c 2d34 3536 2e37 3643 3134 07.43,-456.76C14\n-000101a0: 3839 2e36 332c 2d34 3337 2e33 3920 3134 89.63,-437.39 14\n-000101b0: 3534 2e36 332c 2d33 3936 2e39 3620 3134 54.63,-396.96 14\n-000101c0: 3333 2e35 362c 2d33 3537 2e32 3220 3134 33.56,-357.22 14\n-000101d0: 3133 2e38 362c 2d33 3230 2e30 3620 3134 13.86,-320.06 14\n-000101e0: 3232 2e35 312c 2d33 3035 2e30 3320 3134 22.51,-305.03 14\n-000101f0: 3033 2e35 362c 2d32 3637 2e34 3820 3133 03.56,-267.48 13\n-00010200: 3938 2e36 312c 2d32 3537 2e36 3820 3133 98.61,-257.68 13\n-00010210: 3931 2e38 372c 2d32 3437 2e36 3220 3133 91.87,-247.62 13\n-00010220: 3835 2e36 392c 2d32 3339 2e32 3222 2f3e 85.69,-239.22\"/>\n-00010230: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .<polygon fill=\"\n-00010240: 2362 6662 6662 6622 2073 7472 6f6b 653d #bfbfbf\" stroke=\n-00010250: 2223 6266 6266 6266 2220 706f 696e 7473 \"#bfbfbf\" points\n-00010260: 3d22 3133 3838 2e34 2c2d 3233 3720 3133 =\"1388.4,-237 13\n-00010270: 3739 2e35 362c 2d32 3331 2e31 3620 3133 79.56,-231.16 13\n-00010280: 3832 2e38 332c 2d32 3431 2e32 3420 3133 82.83,-241.24 13\n-00010290: 3838 2e34 2c2d 3233 3722 2f3e 0a3c 2f67 88.4,-237\"/>.</g\n-000102a0: 3e0a 3c21 2d2d 206d 6f64 756c 655f 7372 >.<!-- module_sr\n-000102b0: 635f 6772 6f6d 6163 735f 6d64 7275 6e26 c_gromacs_mdrun&\n-000102c0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-000102d0: 7263 5f67 726f 6d61 6373 5f63 6f6d 7061 rc_gromacs_compa\n-000102e0: 7420 2d2d 3e0a 3c67 2069 643d 2265 6467 t -->.<g id=\"edg\n-000102f0: 6539 3822 2063 6c61 7373 3d22 6564 6765 e98\" class=\"edge\n-00010300: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n-00010310: 5f73 7263 5f67 726f 6d61 6373 5f6d 6472 _src_gromacs_mdr\n-00010320: 756e 2623 3435 3b26 6774 3b6d 6f64 756c un->modul\n-00010330: 655f 7372 635f 6772 6f6d 6163 735f 636f e_src_gromacs_co\n-00010340: 6d70 6174 3c2f 7469 746c 653e 0a3c 7061 mpat....<\n-00010500: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-00010510: 726f 6d61 6373 5f65 7373 656e 7469 616c romacs_essential\n-00010520: 6479 6e61 6d69 6373 202d 2d3e 0a3c 6720 dynamics -->..module_src_grom\n-00010560: 6163 735f 6573 7365 6e74 6961 6c64 796e acs_essentialdyn\n-00010570: 616d 6963 733c 2f74 6974 6c65 3e0a 3c65 amics..essentialdyna\n-00010640: 6d69 6373 3c2f 7465 7874 3e0a 3c2f 673e mics.\n-00010650: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ..\n-000106a0: 3c67 2069 643d 2265 6467 6538 3422 2063 .module_src_g\n-000106d0: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n-000106e0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-000106f0: 6772 6f6d 6163 735f 6573 7365 6e74 6961 gromacs_essentia\n-00010700: 6c64 796e 616d 6963 733c 2f74 6974 6c65 ldynamics.....\n-00010880: 3c67 2069 643d 2265 6467 6537 3822 2063 .module_src_g\n-000108b0: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n-000108c0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-000108d0: 6772 6f6d 6163 735f 6d64 7479 7065 733c gromacs_mdtypes<\n-000108e0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>......module_src_gro\n-00010a90: 6d61 6373 5f6d 6472 756e 2623 3435 3b26 macs_mdrun-&\n-00010aa0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-00010ab0: 6f6d 6163 735f 6d64 6c69 623c 2f74 6974 omacs_mdlib......module_src_gro\n-00010c40: 6d61 6373 5f6d 6472 756e 2623 3435 3b26 macs_mdrun-&\n-00010c50: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-00010c60: 6f6d 6163 735f 6669 6c65 696f 3c2f 7469 omacs_fileio...<\n-00010db0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...modu\n-00010e20: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n-00010e30: 6472 756e 2623 3435 3b26 6774 3b6d 6f64 drun->mod\n-00010e40: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00010e50: 646f 6d64 6563 3c2f 7469 746c 653e 0a3c domdec.<\n-00010e60: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00010e70: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n-00010e80: 2220 643d 224d 3135 3435 2e35 322c 2d34 \" d=\"M1545.52,-4\n-00010e90: 3736 2e33 3843 3135 3534 2e32 372c 2d34 76.38C1554.27,-4\n-00010ea0: 3738 2e37 3220 3135 3633 2e38 312c 2d34 78.72 1563.81,-4\n-00010eb0: 3831 2e32 3620 3135 3732 2e35 362c 2d34 81.26 1572.56,-4\n-00010ec0: 3832 2e39 3620 3137 3034 2e33 332c 2d35 82.96 1704.33,-5\n-00010ed0: 3038 2e36 3120 3138 3632 2e32 2c2d 3532 08.61 1862.2,-52\n-00010ee0: 322e 3333 2031 3933 382e 3333 2c2d 3532 2.33 1938.33,-52\n-00010ef0: 382e 3038 222f 3e0a 3c70 6f6c 7967 6f6e 8.08\"/>...\n-00010f70: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..\n-00010fe0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00010ff0: 6373 5f6d 6472 756e 2623 3435 3b26 6774 cs_mdrun->\n-00011000: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00011010: 6163 735f 7461 736b 6173 7369 676e 6d65 acs_taskassignme\n-00011020: 6e74 3c2f 7469 746c 653e 0a3c 7061 7468 nt..<\n-000110c0: 706f 6c79 676f 6e20 6669 6c6c 3d22 7265 polygon fill=\"re\n-000110d0: 6422 2073 7472 6f6b 653d 2272 6564 2220 d\" stroke=\"red\" \n-000110e0: 706f 696e 7473 3d22 3138 3230 2e31 342c points=\"1820.14,\n-000110f0: 2d34 3230 2e39 3220 3138 3239 2e33 382c -420.92 1829.38,\n-00011100: 2d34 3135 2e37 3420 3138 3138 2e39 332c -415.74 1818.93,\n-00011110: 2d34 3134 2e30 3320 3138 3230 2e31 342c -414.03 1820.14,\n-00011120: 2d34 3230 2e39 3222 2f3e 0a3c 2f67 3e0a -420.92\"/>..\n-00011130: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..mod\n-000111a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-000111b0: 6d64 7275 6e26 2334 353b 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dge105\" class=\"e\n-00011ec0: 6467 6522 3e0a 3c74 6974 6c65 3e6d 6f64 dge\">.<title>mod\n-00011ed0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00011ee0: 696d 6426 2334 353b 2667 743b 6d6f 6475 imd->modu\n-00011ef0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n-00011f00: 6472 756e 7574 696c 6974 793c 2f74 6974 drunutility</tit\n-00011f10: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-00011f20: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n-00011f30: 3832 6663 6322 2073 7472 6f6b 652d 6461 82fcc\" stroke-da\n-00011f40: 7368 6172 7261 793d 2235 2c32 2220 643d sharray=\"5,2\" d=\n-00011f50: 224d 3133 3632 2e30 362c 2d34 3137 2e35 \"M1362.06,-417.5\n-00011f60: 3343 3133 3439 2e34 372c 2d34 3236 2e30 3C1349.47,-426.0\n-00011f70: 3520 3133 3332 2e39 2c2d 3433 392e 3536 5 1332.9,-439.56\n-00011f80: 2031 3332 342e 3536 2c2d 3435 362e 3039 1324.56,-456.09\n-00011f90: 2031 3236 382e 3738 2c2d 3536 362e 3620 1268.78,-566.6 \n-00011fa0: 3132 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module_src_gro\n-00012b80: 6d61 6373 5f74 7261 6a65 6374 6f72 7961 macs_trajectorya\n-00012b90: 6e61 6c79 7369 7320 2d2d 3e0a 3c67 2069 nalysis -->.<g i\n-00012ba0: 643d 226e 6f64 6532 3722 2063 6c61 7373 d=\"node27\" class\n-00012bb0: 3d22 6e6f 6465 223e 0a3c 7469 746c 653e =\"node\">.<title>\n-00012bc0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00012bd0: 6373 5f74 7261 6a65 6374 6f72 7961 6e61 cs_trajectoryana\n-00012be0: 6c79 7369 733c 2f74 6974 6c65 3e0a 3c67 lysis.<\n-00012c00: 6120 786c 696e 6b3a 6872 6566 3d22 6772 a xlink:href=\"gr\n-00012c10: 6f75 705f 5f6d 6f64 756c 655f 5f74 7261 oup__module__tra\n-00012c20: 6a65 6374 6f72 7961 6e61 6c79 7369 732e jectoryanalysis.\n-00012c30: 7868 746d 6c22 2074 6172 6765 743d 225f xhtml\" target=\"_\n-00012c40: 746f 7022 2078 6c69 6e6b 3a74 6974 6c65 top\" xlink:title\n-00012c50: 3d22 7472 616a 6563 746f 7279 616e 616c =\"trajectoryanal\n-00012c60: 7973 6973 223e 0a3c 656c 6c69 7073 6520 ysis\">..<\n-00012cc0: 7465 7874 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module_src_groma\n-00012f80: 6373 5f74 7261 6a65 6374 6f72 7961 6e61 cs_trajectoryana\n-00012f90: 6c79 7369 7326 2334 353b 2667 743b 6d6f lysis->mo\n-00012fa0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00012fb0: 5f61 6e61 6c79 7369 7364 6174 613c 2f74 _analysisdata</t\n-00012fc0: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n-00012fd0: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n-00012fe0: 2332 3832 6663 6322 2073 7472 6f6b 652d #282fcc\" stroke-\n-00012ff0: 6461 7368 6172 7261 793d 2235 2c32 2220 dasharray=\"5,2\" \n-00013000: 643d 224d 3930 312e 3435 2c2d 3339 332e d=\"M901.45,-393.\n-00013010: 3539 4339 3134 2e32 362c 2d33 3834 2e31 59C914.26,-384.1\n-00013020: 3820 3933 322e 3037 2c2d 3337 302e 3532 8 932.07,-370.52\n-00013030: 2039 3436 2e35 362c 2d33 3537 2e32 3220 946.56,-357.22 \n-00013040: 3935 382e 3538 2c2d 3334 362e 3139 2039 958.58,-346.19 9\n-00013050: 3536 2e38 322c 2d33 3337 2e33 3520 3937 56.82,-337.35 97\n-00013060: 312e 3536 2c2d 3333 302e 3335 2031 3038 1.56,-330.35 108\n-00013070: 322e 3631 2c2d 3237 372e 3633 2031 3433 2.61,-277.63 143\n-00013080: 362e 3031 2c2d 3338 302e 3635 2031 3532 6.01,-380.65 152\n-00013090: 332e 3536 2c2d 3239 342e 3335 2031 3533 3.56,-294.35 153\n-000130a0: 372e 3132 2c2d 3238 302e 3938 2031 3533 7.12,-280.98 153\n-000130b0: 372e 3233 2c2d 3235 382e 3535 2031 3533 7.23,-258.55 153\n-000130c0: 342e 3738 2c2d 3234 312e 3634 222f 3e0a 4.78,-241.64\"/>.\n-000130d0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 <polygon fill=\"#\n-000130e0: 3238 3266 6363 2220 7374 726f 6b65 3d22 282fcc\" stroke=\"\n-000130f0: 2332 3832 6663 6322 2070 6f69 6e74 733d #282fcc\" points=\n-00013100: 2231 3533 382e 3137 2c2d 3234 302e 3638 \"1538.17,-240.68\n-00013110: 2031 3533 322e 3932 2c2d 3233 312e 3438 1532.92,-231.48\n-00013120: 2031 3533 312e 3238 2c2d 3234 312e 3934 1531.28,-241.94\n-00013130: 2031 3533 382e 3137 2c2d 3234 302e 3638 1538.17,-240.68\n-00013140: 222f 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f \"/>.</g>.<!-- mo\n-00013150: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00013160: 5f74 7261 6a65 6374 6f72 7961 6e61 6c79 _trajectoryanaly\n-00013170: 7369 7326 2334 353b 2667 743b 6d6f 6475 sis->modu\n-00013180: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n-00013190: 6d78 616e 6120 2d2d 3e0a 3c67 2069 643d mxana -->.<g id=\n-000131a0: 2265 6467 6531 3134 2220 636c 6173 733d \"edge114\" class=\n-000131b0: 2265 6467 6522 3e0a 3c74 6974 6c65 3e6d \"edge\">.<title>m\n-000131c0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-000131d0: 735f 7472 616a 6563 746f 7279 616e 616c s_trajectoryanal\n-000131e0: 7973 6973 2623 3435 3b26 6774 3b6d 6f64 ysis->mod\n-000131f0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00013200: 676d 7861 6e61 3c2f 7469 746c 653e 0a3c gmxana.<\n-00013210: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00013220: 2073 7472 6f6b 653d 2223 3263 6363 3238 stroke=\"#2ccc28\n-00013230: 2220 7374 726f 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stics..\n-00013480: 7374 6174 6973 7469 6373 3c2f 7465 7874 statistics....module_src_grom\n-00013520: 6163 735f 7472 616a 6563 746f 7279 616e acs_trajectoryan\n-00013530: 616c 7973 6973 2623 3435 3b26 6774 3b6d alysis->m\n-00013540: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-00013550: 735f 7374 6174 6973 7469 6373 3c2f 7469 s_statistics..\n-00013650: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module_src_gr\n-000136e0: 6f6d 6163 735f 7472 616a 6563 746f 7279 omacs_trajectory\n-000136f0: 616e 616c 7973 6973 2623 3435 3b26 6774 analysis->\n-00013700: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00013710: 6163 735f 676d 7870 7265 7072 6f63 6573 acs_gmxpreproces\n-00013720: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s...<\n-000138d0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...module\n-00013950: 5f73 7263 5f67 726f 6d61 6373 5f74 7261 _src_gromacs_tra\n-00013960: 6a65 6374 6f72 7961 6e61 6c79 7369 7326 jectoryanalysis&\n-00013970: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00013980: 7263 5f67 726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n-00013990: 6f3c 2f74 6974 6c65 3e0a 3c70 6174 6820 o......mod\n-00013bb0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00013bc0: 7472 616a 6563 746f 7279 616e 616c 7973 trajectoryanalys\n-00013bd0: 6973 2623 3435 3b26 6774 3b6d 6f64 756c is->modul\n-00013be0: 655f 7372 635f 6772 6f6d 6163 735f 636f e_src_gromacs_co\n-00013bf0: 6d6d 616e 646c 696e 653c 2f74 6974 6c65 mmandline</title\n-00013c00: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n-00013c10: 6e65 2220 7374 726f 6b65 3d22 2332 3832 ne\" stroke=\"#282\n-00013c20: 6663 6322 2073 7472 6f6b 652d 6461 7368 fcc\" stroke-dash\n-00013c30: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n-00013c40: 3836 362e 3137 2c2d 3339 332e 3635 4338 866.17,-393.65C8\n-00013c50: 3037 2e37 392c 2d33 3535 2e35 3920 3632 07.79,-355.59 62\n-00013c60: 362e 3835 2c2d 3233 382e 3137 2035 3635 6.85,-238.17 565\n-00013c70: 2e35 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cy=\"-343.79\n-00013e40: 2220 7278 3d22 3438 2e35 3822 2072 793d \" rx=\"48.58\" ry=\n-00013e50: 2231 332e 3337 222f 3e0a 3c74 6578 7420 \"13.37\"/>.<text \n-00013e60: 7465 7874 2d61 6e63 686f 723d 226d 6964 text-anchor=\"mid\n-00013e70: 646c 6522 2078 3d22 3838 382e 3536 2220 dle\" x=\"888.56\" \n-00013e80: 793d 222d 3334 312e 3239 2220 666f 6e74 y=\"-341.29\" font\n-00013e90: 2d66 616d 696c 793d 2246 7265 6553 616e -family=\"FreeSan\n-00013ea0: 7322 2066 6f6e 742d 7369 7a65 3d22 3130 s\" font-size=\"10\n-00013eb0: 2e30 3022 3e63 6f6f 7264 696e 6174 6569 .00\">coordinatei\n-00013ec0: 6f3c 2f74 6578 743e 0a3c 2f61 3e0a 3c2f o</text>.</a>.</\n-00013ed0: 673e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 g>.</g>.<!-- mod\n-00013ee0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00013ef0: 7472 616a 6563 746f 7279 616e 616c 7973 trajectoryanalys\n-00013f00: 6973 2623 3435 3b26 6774 3b6d 6f64 756c is->modul\n-00013f10: 655f 7372 635f 6772 6f6d 6163 735f 636f e_src_gromacs_co\n-00013f20: 6f72 6469 6e61 7465 696f 202d 2d3e 0a3c ordinateio -->.<\n-00013f30: 6720 6964 3d22 6564 6765 3131 3022 2063 g id=\"edge110\" c\n-00013f40: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.<ti\n-00013f50: 746c 653e 6d6f 6475 6c65 5f73 7263 5f67 tle>module_src_g\n-00013f60: 726f 6d61 6373 5f74 7261 6a65 6374 6f72 romacs_trajector\n-00013f70: 7961 6e61 6c79 7369 7326 2334 353b 2667 yanalysis-&g\n-00013f80: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00013f90: 6d61 6373 5f63 6f6f 7264 696e 6174 6569 macs_coordinatei\n-00013fa0: 6f3c 2f74 6974 6c65 3e0a 3c70 6174 6820 o......module_src_gro\n-00014120: 6d61 6373 5f61 7070 6c69 6564 5f66 6f72 macs_applied_for\n-00014130: 6365 7326 2334 353b 2667 743b 6d6f 6475 ces->modu\n-00014140: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n-00014150: 6472 756e 7574 696c 6974 793c 2f74 6974 drunutility......mod\n-00014360: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00014370: 6170 706c 6965 645f 666f 7263 6573 2623 applied_forces&#\n-00014380: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00014390: 635f 6772 6f6d 6163 735f 7261 6e64 6f6d c_gromacs_random\n-000143a0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......mod\n-00014510: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00014520: 6170 706c 6965 645f 666f 7263 6573 2623 applied_forces&#\n-00014530: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00014540: 635f 6772 6f6d 6163 735f 6d64 7370 616e c_gromacs_mdspan\n-00014550: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......modu\n-000147b0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f61 le_src_gromacs_a\n-000147c0: 7070 6c69 6564 5f66 6f72 6365 7326 2334 pplied_forces\n-000147d0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-000147e0: 5f67 726f 6d61 6373 5f6f 7074 696f 6e73 _gromacs_options\n-000147f0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 .....\n-00014960: 3c67 2069 643d 2265 6467 6531 3232 2220 .module_src_\n-00014990: 6772 6f6d 6163 735f 6170 706c 6965 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8.42,-415.73C132\n-00014e00: 362e 3433 2c2d 3431 372e 3232 2031 3333 6.43,-417.22 133\n-00014e10: 342e 3735 2c2d 3431 382e 3734 2031 3334 4.75,-418.74 134\n-00014e20: 322e 3536 2c2d 3432 302e 3039 2031 3739 2.56,-420.09 179\n-00014e30: 322e 3637 2c2d 3439 382e 3137 2031 3635 2.67,-498.17 165\n-00014e40: 382e 3935 2c2d 3335 392e 3934 2031 3536 8.95,-359.94 156\n-00014e50: 392e 3536 2c2d 3438 322e 3936 2031 3332 9.56,-482.96 132\n-00014e60: 362e 3436 2c2d 3831 372e 3533 2039 3237 6.46,-817.53 927\n-00014e70: 2e36 362c 2d34 3335 2e38 3720 3638 342e .66,-435.87 684.\n-00014e80: 3536 2c2d 3737 302e 3434 2036 3433 2e35 56,-770.44 643.5\n-00014e90: 342c 2d38 3236 2e39 2036 3638 2e38 2c2d 4,-826.9 668.8,-\n-00014ea0: 3837 372e 3336 2037 3231 2e35 362c 2d39 877.36 721.56,-9\n-00014eb0: 3233 2e30 3520 3736 302e 3632 2c2d 3935 23.05 760.62,-95\n-00014ec0: 362e 3837 2039 3033 2e35 2c2d 3936 372e 6.87 903.5,-967.\n-00014ed0: 3039 2039 3930 2e31 382c 2d39 3730 2e31 09 990.18,-970.1\n-00014ee0: 3722 2f3e 0a3c 706f 6c79 676f 6e20 6669 7\"/>.....module\n-00014fd0: 5f73 7263 5f67 726f 6d61 6373 5f61 7070 _src_gromacs_app\n-00014fe0: 6c69 6564 5f66 6f72 6365 7326 2334 353b lied_forces-\n-00014ff0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-00015000: 726f 6d61 6373 5f6d 646c 6962 3c2f 7469 romacs_mdlib</ti\n-00015010: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-00015020: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-00015030: 3238 3266 6363 2220 7374 726f 6b65 2d64 282fcc\" stroke-d\n-00015040: 6173 6861 7272 6179 3d22 352c 3222 2064 asharray=\"5,2\" d\n-00015050: 3d22 4d31 3237 382e 3435 2c2d 3432 302e =\"M1278.45,-420.\n-00015060: 3139 4331 3238 342e 3434 2c2d 3435 352e 19C1284.44,-455.\n-00015070: 3433 2031 3330 362e 3239 2c2d 3535 362e 43 1306.29,-556.\n-00015080: 3231 2031 3336 362e 3536 2c2d 3630 382e 21 1366.56,-608.\n-00015090: 3720 3133 3832 2e35 382c 2d36 3232 2e36 7 1382.58,-622.6\n-000150a0: 3520 3134 3336 2e32 322c 2d36 3338 2e37 5 1436.22,-638.7\n-000150b0: 3720 3134 3732 2e32 362c 2d36 3438 2e34 7 1472.26,-648.4\n-000150c0: 3422 2f3e 0a3c 706f 6c79 676f 6e20 6669 4\"/>.<polygon fi\n-000150d0: 6c6c 3d22 2332 3832 6663 6322 2073 7472 ll=\"#282fcc\" str\n-000150e0: 6f6b 653d 2223 3238 3266 6363 2220 706f oke=\"#282fcc\" po\n-000150f0: 696e 7473 3d22 3134 3731 2e38 2c2d 3635 ints=\"1471.8,-65\n-00015100: 312e 3934 2031 3438 322e 3336 2c2d 3635 1.94 1482.36,-65\n-00015110: 312e 3131 2031 3437 332e 3539 2c2d 3634 1.11 1473.59,-64\n-00015120: 352e 3137 2031 3437 312e 382c 2d36 3531 5.17 1471.8,-651\n-00015130: 2e39 3422 2f3e 0a3c 2f67 3e0a 3c21 2d2d .94\"/>.</g>.<!--\n-00015140: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n-00015150: 6163 735f 6170 706c 6965 645f 666f 7263 acs_applied_forc\n-00015160: 6573 2623 3435 3b26 6774 3b6d 6f64 756c es->modul\n-00015170: 655f 7372 635f 6772 6f6d 6163 735f 6669 e_src_gromacs_fi\n-00015180: 6c65 696f 202d 2d3e 0a3c 6720 6964 3d22 leio -->.<g id=\"\n-00015190: 6564 6765 3131 3622 2063 6c61 7373 3d22 edge116\" class=\"\n-000151a0: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n-000151b0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-000151c0: 5f61 7070 6c69 6564 5f66 6f72 6365 7326 _applied_forces&\n-000151d0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-000151e0: 7263 5f67 726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n-000151f0: 6f3c 2f74 6974 6c65 3e0a 3c70 6174 6820 o......mod\n-000153b0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-000153c0: 6170 706c 6965 645f 666f 7263 6573 2623 applied_forces&#\n-000153d0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-000153e0: 635f 6772 6f6d 6163 735f 646f 6d64 6563 c_gromacs_domdec\n-000153f0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ....<\n-00015580: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-00015590: 726f 6d61 6373 5f61 7070 6c69 6564 5f66 romacs_applied_f\n-000155a0: 6f72 6365 7326 2334 353b 2667 743b 6d6f orces->mo\n-000155b0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-000155c0: 5f63 6f6d 6d61 6e64 6c69 6e65 202d 2d3e _commandline -->\n-000155d0: 0a3c 6720 6964 3d22 6564 6765 3131 3522 ..<\n-000155f0: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00015600: 5f67 726f 6d61 6373 5f61 7070 6c69 6564 _gromacs_applied\n-00015610: 5f66 6f72 6365 7326 2334 353b 2667 743b _forces->\n-00015620: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00015630: 6373 5f63 6f6d 6d61 6e64 6c69 6e65 3c2f cs_commandline......mod\n-00015830: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00015840: 6170 706c 6965 645f 666f 7263 6573 2623 applied_forces&#\n-00015850: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00015860: 635f 6772 6f6d 6163 735f 6577 616c 643c c_gromacs_ewald<\n-00015870: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n-00015880: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n-00015890: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n-000158a0: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n-000158b0: 2220 643d 224d 3132 3938 2e31 342c 2d34 \" d=\"M1298.14,-4\n-000158c0: 3139 2e31 3943 3133 3538 2e38 322c 2d34 19.19C1358.82,-4\n-000158d0: 3531 2e36 3420 3135 3330 2e39 312c 2d35 51.64 1530.91,-5\n-000158e0: 3433 2e36 3520 3135 3938 2e31 352c 2d35 43.65 1598.15,-5\n-000158f0: 3739 2e36 3122 2f3e 0a3c 706f 6c79 676f 79.61\"/>.<polygo\n-00015900: 6e20 6669 6c6c 3d22 2332 3832 6663 6322 n fill=\"#282fcc\"\n-00015910: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n-00015920: 2220 706f 696e 7473 3d22 3135 3936 2e38 \" points=\"1596.8\n-00015930: 322c 2d35 3832 2e38 3720 3136 3037 2e32 2,-582.87 1607.2\n-00015940: 392c 2d35 3834 2e35 2031 3630 302e 3132 9,-584.5 1600.12\n-00015950: 2c2d 3537 362e 3639 2031 3539 362e 3832 ,-576.69 1596.82\n-00015960: 2c2d 3538 322e 3837 222f 3e0a 3c2f 673e ,-582.87\"/>.</g>\n-00015970: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 .<!-- module_src\n-00015980: 5f67 726f 6d61 6373 5f67 6d78 616e 6126 _gromacs_gmxana&\n-00015990: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-000159a0: 7263 5f67 726f 6d61 6373 5f72 616e 646f rc_gromacs_rando\n-000159b0: 6d20 2d2d 3e0a 3c67 2069 643d 2265 6467 m -->.<g id=\"edg\n-000159c0: 6531 3333 2220 636c 6173 733d 2265 6467 e133\" class=\"edg\n-000159d0: 6522 3e0a 3c74 6974 6c65 3e6d 6f64 756c e\">.<title>modul\n-000159e0: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n-000159f0: 7861 6e61 2623 3435 3b26 6774 3b6d 6f64 xana->mod\n-00015a00: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00015a10: 7261 6e64 6f6d 3c2f 7469 746c 653e 0a3c random.<\n-00015a20: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00015a30: 2073 7472 6f6b 653d 2262 6c61 636b 2220 stroke=\"black\" \n-00015a40: 7374 726f 6b65 2d64 6173 6861 7272 6179 stroke-dasharray\n-00015a50: 3d22 352c 3222 2064 3d22 4d37 3239 2e36 =\"5,2\" d=\"M729.6\n-00015a60: 382c 2d37 3730 2e32 3943 3733 332e 3036 8,-770.29C733.06\n-00015a70: 2c2d 3733 372e 3336 2037 3435 2e32 372c ,-737.36 745.27,\n-00015a80: 2d36 3436 2e37 3320 3738 312e 3536 2c2d -646.73 781.56,-\n-00015a90: 3538 312e 3833 2038 3139 2e32 362c 2d35 581.83 819.26,-5\n-00015aa0: 3134 2e34 3120 3834 312e 3739 2c2d 3530 14.41 841.79,-50\n-00015ab0: 352e 3033 2039 3031 2e35 362c 2d34 3536 5.03 901.56,-456\n-00015ac0: 2e30 3920 3932 342e 3734 2c2d 3433 372e .09 924.74,-437.\n-00015ad0: 3131 2039 3335 2e35 2c2d 3433 392e 3232 11 935.5,-439.22\n-00015ae0: 2039 3538 2e35 362c 2d34 3230 2e30 3920 958.56,-420.09 \n-00015af0: 3937 312e 3132 2c2d 3430 392e 3638 2039 971.12,-409.68 9\n-00015b00: 3732 2e33 322c 2d34 3035 2e30 3520 3938 72.32,-405.05 98\n-00015b10: 332e 3536 2c2d 3339 332e 3232 2039 3932 3.56,-393.22 992\n-00015b20: 2e38 2c2d 3338 332e 3520 3130 3033 2e31 .8,-383.5 1003.1\n-00015b30: 372c 2d33 3732 2e37 3920 3130 3131 2e38 7,-372.79 1011.8\n-00015b40: 322c 2d33 3633 2e39 3122 2f3e 0a3c 706f 2,-363.91\"/>..\n-00015bc0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...modul\n-00015c30: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n-00015c40: 7861 6e61 2623 3435 3b26 6774 3b6d 6f64 xana->mod\n-00015c50: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00015c60: 6d64 7370 616e 3c2f 7469 746c 653e 0a3c mdspan.<\n-00015c70: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00015c80: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n-00015c90: 2220 7374 726f 6b65 2d64 6173 6861 7272 \" stroke-dasharr\n-00015ca0: 6179 3d22 352c 3222 2064 3d22 4d37 3231 ay=\"5,2\" d=\"M721\n-00015cb0: 2e30 392c 2d37 3730 2e34 3343 3731 352e .09,-770.43C715.\n-00015cc0: 3531 2c2d 3736 302e 3832 2037 3037 2e39 51,-760.82 707.9\n-00015cd0: 362c 2d37 3437 2e30 3820 3730 322e 3536 6,-747.08 702.56\n-00015ce0: 2c2d 3733 342e 3434 2036 3332 2e32 2c2d ,-734.44 632.2,-\n-00015cf0: 3536 392e 3833 2036 3030 2e35 362c 2d35 569.83 600.56,-5\n-00015d00: 3233 2e38 2036 3030 2e35 362c 2d33 3434 23.8 600.56,-344\n-00015d10: 2e37 3920 3630 302e 3536 2c2d 3334 342e .79 600.56,-344.\n-00015d20: 3739 2036 3030 2e35 362c 2d33 3434 2e37 79 600.56,-344.7\n-00015d30: 3920 3630 302e 3536 2c2d 3231 372e 3035 9 600.56,-217.05\n-00015d40: 2036 3030 2e35 362c 2d31 3639 2e38 3120 600.56,-169.81 \n-00015d50: 3633 322e 3933 2c2d 3136 322e 3038 2036 632.93,-162.08 6\n-00015d60: 3735 2e35 362c 2d31 3431 2e37 3420 3836 75.56,-141.74 86\n-00015d70: 332c 2d35 322e 3334 2031 3532 372e 392c 3,-52.34 1527.9,\n-00015d80: 2d33 342e 3338 2031 3730 392e 3436 2c2d -34.38 1709.46,-\n-00015d90: 3331 2e31 3122 2f3e 0a3c 706f 6c79 676f 31.11\"/>.....m\n-00015e80: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-00015e90: 735f 676d 7861 6e61 2623 3435 3b26 6774 s_gmxana->\n-00015ea0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00015eb0: 6163 735f 6c69 7374 6564 5f66 6f72 6365 acs_listed_force\n-00015ec0: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s.....\n-00016130: 3c67 2069 643d 2265 6467 6531 3239 2220 .module_src_\n-00016160: 6772 6f6d 6163 735f 676d 7861 6e61 2623 gromacs_gmxana&#\n-00016170: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00016180: 635f 6772 6f6d 6163 735f 636f 7272 656c c_gromacs_correl\n-00016190: 6174 696f 6e66 756e 6374 696f 6e73 3c2f ationfunctions..<\n-00016250: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n-00016260: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n-00016270: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n-00016280: 3433 342e 3539 2c2d 3631 352e 3238 2034 434.59,-615.28 4\n-00016290: 3236 2e32 312c 2d36 3038 2e38 2034 3238 26.21,-608.8 428\n-000162a0: 2e37 322c 2d36 3139 2e30 3920 3433 342e .72,-619.09 434.\n-000162b0: 3539 2c2d 3631 352e 3238 222f 3e0a 3c2f 59,-615.28\"/>....module\n-00016330: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n-00016340: 616e 6126 2334 353b 2667 743b 6d6f 6475 ana->modu\n-00016350: 6c65 5f73 7263 5f67 726f 6d61 6373 5f66 le_src_gromacs_f\n-00016360: 6674 3c2f 7469 746c 653e 0a3c 7061 7468 ft....\n-000164f0: 0a3c 6720 6964 3d22 6564 6765 3133 3422 ..<\n-00016510: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00016520: 5f67 726f 6d61 6373 5f67 6d78 616e 6126 _gromacs_gmxana&\n-00016530: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00016540: 7263 5f67 726f 6d61 6373 5f67 6d78 6c69 rc_gromacs_gmxli\n-00016550: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b...\n-00016690: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...\n-00016700: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00016710: 6373 5f67 6d78 616e 6126 2334 353b 2667 cs_gmxana-&g\n-00016720: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00016730: 6d61 6373 5f6d 6474 7970 6573 3c2f 7469 macs_mdtypes</ti\n-00016740: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-00016750: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-00016760: 6266 6266 6266 2220 643d 224d 3736 332e bfbfbf\" d=\"M763.\n-00016770: 3635 2c2d 3738 312e 3939 4338 3833 2e38 65,-781.99C883.8\n-00016780: 382c 2d37 3738 2e37 3520 3132 3930 2e33 8,-778.75 1290.3\n-00016790: 342c 2d37 3636 2e30 3120 3136 3234 2e35 4,-766.01 1624.5\n-000167a0: 362c 2d37 3334 2e34 3420 3136 3430 2e32 6,-734.44 1640.2\n-000167b0: 2c2d 3733 322e 3936 2031 3635 372e 3238 ,-732.96 1657.28\n-000167c0: 2c2d 3733 302e 3831 2031 3637 322e 3432 ,-730.81 1672.42\n-000167d0: 2c2d 3732 382e 3722 2f3e 0a3c 706f 6c79 ,-728.7\"/>.<poly\n-000167e0: 676f 6e20 6669 6c6c 3d22 2362 6662 6662 gon fill=\"#bfbfb\n-000167f0: 6622 2073 7472 6f6b 653d 2223 6266 6266 f\" stroke=\"#bfbf\n-00016800: 6266 2220 706f 696e 7473 3d22 3136 3733 bf\" points=\"1673\n-00016810: 2e31 352c 2d37 3332 2e31 3420 3136 3832 .15,-732.14 1682\n-00016820: 2e35 362c 2d37 3237 2e32 3720 3136 3732 .56,-727.27 1672\n-00016830: 2e31 362c 2d37 3235 2e32 3120 3136 3733 .16,-725.21 1673\n-00016840: 2e31 352c 2d37 3332 2e31 3422 2f3e 0a3c .15,-732.14\"/>.<\n-00016850: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.<!-- module_\n-00016860: 7372 635f 6772 6f6d 6163 735f 676d 7861 src_gromacs_gmxa\n-00016870: 6e61 2623 3435 3b26 6774 3b6d 6f64 756c na->modul\n-00016880: 655f 7372 635f 6772 6f6d 6163 735f 7374 e_src_gromacs_st\n-00016890: 6174 6973 7469 6373 202d 2d3e 0a3c 6720 atistics -->.<g \n-000168a0: 6964 3d22 6564 6765 3133 3722 2063 6c61 id=\"edge137\" cla\n-000168b0: 7373 3d22 6564 6765 223e 0a3c 7469 746c ss=\"edge\">.<titl\n-000168c0: 653e 6d6f 6475 6c65 5f73 7263 5f67 726f e>module_src_gro\n-000168d0: 6d61 6373 5f67 6d78 616e 6126 2334 353b macs_gmxana-\n-000168e0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-000168f0: 726f 6d61 6373 5f73 7461 7469 7374 6963 romacs_statistic\n-00016900: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s......modu\n-00016af0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n-00016b00: 6d78 616e 6126 2334 353b 2667 743b 6d6f mxana->mo\n-00016b10: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00016b20: 5f6d 646c 6962 3c2f 7469 746c 653e 0a3c _mdlib.<\n-00016b30: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00016b40: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n-00016b50: 2220 643d 224d 3736 302e 3531 2c2d 3737 \" d=\"M760.51,-77\n-00016b60: 372e 3739 4338 3835 2e30 392c 2d37 3537 7.79C885.09,-757\n-00016b70: 2e39 3820 3133 3337 2e39 2c2d 3638 352e .98 1337.9,-685.\n-00016b80: 3936 2031 3437 302e 3039 2c2d 3636 342e 96 1470.09,-664.\n-00016b90: 3934 222f 3e0a 3c70 6f6c 7967 6f6e 2066 94\"/>...<\n-00016c10: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-00016c20: 726f 6d61 6373 5f67 6d78 616e 6126 2334 romacs_gmxana\n-00016c30: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00016c40: 5f67 726f 6d61 6373 5f66 696c 6569 6f20 _gromacs_fileio \n-00016c50: 2d2d 3e0a 3c67 2069 643d 2265 6467 6531 -->..module_\n-00016c80: 7372 635f 6772 6f6d 6163 735f 676d 7861 src_gromacs_gmxa\n-00016c90: 6e61 2623 3435 3b26 6774 3b6d 6f64 756c na->modul\n-00016ca0: 655f 7372 635f 6772 6f6d 6163 735f 6669 e_src_gromacs_fi\n-00016cb0: 6c65 696f 3c2f 7469 746c 653e 0a3c 7061 leio.....<\n-00017140: 6720 6964 3d22 6564 6765 3133 3122 2063 g id=\"edge131\" c\n-00017150: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-00017170: 726f 6d61 6373 5f67 6d78 616e 6126 2334 romacs_gmxana\n-00017180: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00017190: 5f67 726f 6d61 6373 5f74 7261 6a65 6374 _gromacs_traject\n-000171a0: 6f72 793c 2f74 6974 6c65 3e0a 3c70 6174 ory..<\n-00017370: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n-00017380: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n-00017390: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n-000173a0: 3236 332e 3534 2c2d 3533 2e35 3320 3236 263.54,-53.53 26\n-000173b0: 332e 3535 2c2d 3432 2e39 3420 3235 362e 3.55,-42.94 256.\n-000173c0: 3934 2c2d 3531 2e32 3220 3236 332e 3534 94,-51.22 263.54\n-000173d0: 2c2d 3533 2e35 3322 2f3e 0a3c 2f67 3e0a ,-53.53\"/>..\n-000173e0: 3c21 2d2d 206d 6f64 756c 655f 7372 635f \n-00017430: 0a3c 6720 6964 3d22 6564 6765 3133 3822 ..<\n-00017450: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00017460: 5f67 726f 6d61 6373 5f67 6d78 616e 6126 _gromacs_gmxana&\n-00017470: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00017480: 7263 5f67 726f 6d61 6373 5f61 7070 6c69 rc_gromacs_appli\n-00017490: 6564 5f66 6f72 6365 735f 6177 683c 2f74 ed_forces_awh......module_src_gr\n-00017640: 6f6d 6163 735f 676d 786c 6962 2623 3435 omacs_gmxlib-\n-00017650: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00017660: 6772 6f6d 6163 735f 7461 626c 6573 3c2f gromacs_tables......module_src_grom\n-00017a90: 6163 735f 676d 786c 6962 2623 3435 3b26 acs_gmxlib-&\n-00017aa0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-00017ab0: 6f6d 6163 735f 6d64 6c69 623c 2f74 6974 omacs_mdlib......modul\n-00017c60: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n-00017c70: 786c 6962 2623 3435 3b26 6774 3b6d 6f64 xlib->mod\n-00017c80: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00017c90: 636f 6d6d 616e 646c 696e 653c 2f74 6974 commandline</tit\n-00017ca0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-00017cb0: 6e6f 6e65 2220 7374 726f 6b65 3d22 626c none\" stroke=\"bl\n-00017cc0: 6163 6b22 2073 7472 6f6b 652d 6461 7368 ack\" stroke-dash\n-00017cd0: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n-00017ce0: 3133 3338 2e33 342c 2d32 3134 2e39 3543 1338.34,-214.95C\n-00017cf0: 3132 3036 2e39 332c 2d32 3036 2e31 3320 1206.93,-206.13 \n-00017d00: 3639 372e 3535 2c2d 3137 312e 3935 2035 697.55,-171.95 5\n-00017d10: 3232 2e32 332c 2d31 3630 2e31 3822 2f3e 22.23,-160.18\"/>\n-00017d20: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .<polygon fill=\"\n-00017d30: 626c 6163 6b22 2073 7472 6f6b 653d 2262 black\" stroke=\"b\n-00017d40: 6c61 636b 2220 706f 696e 7473 3d22 3532 lack\" points=\"52\n-00017d50: 322e 3337 2c2d 3135 362e 3638 2035 3132 2.37,-156.68 512\n-00017d60: 2e31 362c 2d31 3539 2e35 2035 3231 2e39 .16,-159.5 521.9\n-00017d70: 2c2d 3136 332e 3637 2035 3232 2e33 372c ,-163.67 522.37,\n-00017d80: 2d31 3536 2e36 3822 2f3e 0a3c 2f67 3e0a -156.68\"/>.</g>.\n-00017d90: 3c21 2d2d 206d 6f64 756c 655f 7372 635f <!-- module_src_\n-00017da0: 6772 6f6d 6163 735f 676d 786c 6962 2623 gromacs_gmxlib&#\n-00017db0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00017dc0: 635f 6772 6f6d 6163 735f 6577 616c 6420 c_gromacs_ewald \n-00017dd0: 2d2d 3e0a 3c67 2069 643d 2265 6467 6531 -->.<g id=\"edge1\n-00017de0: 3432 2220 636c 6173 733d 2265 6467 6522 42\" class=\"edge\"\n-00017df0: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n-00017e00: 7372 635f 6772 6f6d 6163 735f 676d 786c src_gromacs_gmxl\n-00017e10: 6962 2623 3435 3b26 6774 3b6d 6f64 756c ib->modul\n-00017e20: 655f 7372 635f 6772 6f6d 6163 735f 6577 e_src_gromacs_ew\n-00017e30: 616c 643c 2f74 6974 6c65 3e0a 3c70 6174 ald..\n-00017fc0: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module_src_grom\n-00018050: 6163 735f 6573 7365 6e74 6961 6c64 796e acs_essentialdyn\n-00018060: 616d 6963 7326 2334 353b 2667 743b 6d6f amics->mo\n-00018070: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00018080: 5f6d 6472 756e 7574 696c 6974 793c 2f74 _mdrunutility......\n-000182c0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-000182d0: 6373 5f65 7373 656e 7469 616c 6479 6e61 cs_essentialdyna\n-000182e0: 6d69 6373 2623 3435 3b26 6774 3b6d 6f64 mics->mod\n-000182f0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00018300: 676d 786c 6962 3c2f 7469 746c 653e 0a3c gmxlib.<\n-00018310: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00018320: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n-00018330: 2220 643d 224d 3135 3430 2e33 2c2d 3333 \" d=\"M1540.3,-33\n-00018340: 312e 3238 4331 3532 312e 3131 2c2d 3332 1.28C1521.11,-32\n-00018350: 322e 3335 2031 3439 342e 3832 2c2d 3330 2.35 1494.82,-30\n-00018360: 392e 3036 2031 3437 332e 3536 2c2d 3239 9.06 1473.56,-29\n-00018370: 342e 3335 2031 3435 382e 3834 2c2d 3238 4.35 1458.84,-28\n-00018380: 342e 3137 2031 3435 372e 3736 2c2d 3237 4.17 1457.76,-27\n-00018390: 382e 3338 2031 3434 332e 3536 2c2d 3236 8.38 1443.56,-26\n-000183a0: 372e 3438 2031 3432 382e 3338 2c2d 3235 7.48 1428.38,-25\n-000183b0: 352e 3832 2031 3431 302e 3433 2c2d 3234 5.82 1410.43,-24\n-000183c0: 342e 3033 2031 3339 362e 3031 2c2d 3233 4.03 1396.01,-23\n-000183d0: 3522 2f3e 0a3c 706f 6c79 676f 6e20 6669 5\"/>....<\n-000184a0: 6720 6964 3d22 6564 6765 3135 3122 2063 g id=\"edge151\" c\n-000184b0: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-000184d0: 726f 6d61 6373 5f65 7373 656e 7469 616c romacs_essential\n-000184e0: 6479 6e61 6d69 6373 2623 3435 3b26 6774 dynamics->\n-000184f0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00018500: 6163 735f 6d64 7479 7065 733c 2f74 6974 acs_mdtypes..\n-00018620: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module\n-000186a0: 5f73 7263 5f67 726f 6d61 6373 5f65 7373 _src_gromacs_ess\n-000186b0: 656e 7469 616c 6479 6e61 6d69 6373 2623 entialdynamics&#\n-000186c0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-000186d0: 635f 6772 6f6d 6163 735f 6d64 6c69 623c c_gromacs_mdlib<\n-000186e0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n-000186f0: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n-00018700: 3d22 2362 6662 6662 6622 2064 3d22 4d31 =\"#bfbfbf\" d=\"M1\n-00018710: 3535 372e 3437 2c2d 3335 372e 3237 4331 557.47,-357.27C1\n-00018720: 3533 392e 3337 2c2d 3337 362e 3038 2031 539.37,-376.08 1\n-00018730: 3530 312e 3535 2c2d 3431 342e 3031 2031 501.55,-414.01 1\n-00018740: 3438 372e 3536 2c2d 3435 362e 3039 2031 487.56,-456.09 1\n-00018750: 3436 362e 3832 2c2d 3531 382e 3438 2031 466.82,-518.48 1\n-00018760: 3439 312e 3138 2c2d 3539 362e 3732 2031 491.18,-596.72 1\n-00018770: 3530 322e 3434 2c2d 3633 342e 3537 222f 502.44,-634.57\"/\n-00018780: 3e0a 3c70 6f6c 7967 6f6e 2066 696c 6c3d >.<polygon fill=\n-00018790: 2223 6266 6266 6266 2220 7374 726f 6b65 \"#bfbfbf\" stroke\n-000187a0: 3d22 2362 6662 6662 6622 2070 6f69 6e74 =\"#bfbfbf\" point\n-000187b0: 733d 2231 3439 392e 3139 2c2d 3633 352e s=\"1499.19,-635.\n-000187c0: 3931 2031 3530 352e 3333 2c2d 3634 342e 91 1505.33,-644.\n-000187d0: 3534 2031 3530 352e 3931 2c2d 3633 332e 54 1505.91,-633.\n-000187e0: 3936 2031 3439 392e 3139 2c2d 3633 352e 96 1499.19,-635.\n-000187f0: 3931 222f 3e0a 3c2f 673e 0a3c 212d 2d20 91\"/>.</g>.<!-- \n-00018800: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00018810: 6373 5f65 7373 656e 7469 616c 6479 6e61 cs_essentialdyna\n-00018820: 6d69 6373 2623 3435 3b26 6774 3b6d 6f64 mics->mod\n-00018830: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00018840: 6669 6c65 696f 202d 2d3e 0a3c 6720 6964 fileio -->.<g id\n-00018850: 3d22 6564 6765 3134 3722 2063 6c61 7373 =\"edge147\" class\n-00018860: 3d22 6564 6765 223e 0a3c 7469 746c 653e =\"edge\">.<title>\n-00018870: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00018880: 6373 5f65 7373 656e 7469 616c 6479 6e61 cs_essentialdyna\n-00018890: 6d69 6373 2623 3435 3b26 6774 3b6d 6f64 mics->mod\n-000188a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-000188b0: 6669 6c65 696f 3c2f 7469 746c 653e 0a3c fileio.<\n-000188c0: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-000188d0: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n-000188e0: 2220 643d 224d 3136 3032 2e36 392c 2d33 \" d=\"M1602.69,-3\n-000188f0: 3332 2e32 3343 3136 3436 2e32 392c 2d33 32.23C1646.29,-3\n-00018900: 3137 2e34 3320 3137 3138 2e30 332c 2d32 17.43 1718.03,-2\n-00018910: 3836 2e30 3120 3137 3532 2e35 362c 2d32 86.01 1752.56,-2\n-00018920: 3331 2e34 3820 3137 3734 2e30 362c 2d31 31.48 1774.06,-1\n-00018930: 3937 2e35 3320 3137 3836 2e36 382c 2d31 97.53 1786.68,-1\n-00018940: 3734 2e36 2031 3736 332e 3536 2c2d 3134 74.6 1763.56,-14\n-00018950: 312e 3734 2031 3735 312e 3639 2c2d 3132 1.74 1751.69,-12\n-00018960: 342e 3837 2031 3639 382e 3636 2c2d 3130 4.87 1698.66,-10\n-00018970: 392e 3536 2031 3636 322e 372c 2d31 3030 9.56 1662.7,-100\n-00018980: 2e38 3422 2f3e 0a3c 706f 6c79 676f 6e20 .84\"/>.....module_src_gro\n-00018a80: 6d61 6373 5f65 7373 656e 7469 616c 6479 macs_essentialdy\n-00018a90: 6e61 6d69 6373 2623 3435 3b26 6774 3b6d namics->m\n-00018aa0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-00018ab0: 735f 646f 6d64 6563 3c2f 7469 746c 653e s_domdec\n-00018ac0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e .\n-00018ba0: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 ....<\n-00018c70: 6720 6964 3d22 6564 6765 3134 3522 2063 g id=\"edge145\" c\n-00018c80: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-00018ca0: 726f 6d61 6373 5f65 7373 656e 7469 616c romacs_essential\n-00018cb0: 6479 6e61 6d69 6373 2623 3435 3b26 6774 dynamics->\n-00018cc0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00018cd0: 6163 735f 636f 6d6d 616e 646c 696e 653c acs_commandline<\n-00018ce0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>...\n-00018e30: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...module_src_gr\n-00018eb0: 6f6d 6163 735f 6d64 7479 7065 7326 2334 omacs_mdtypes\n-00018ec0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00018ed0: 5f67 726f 6d61 6373 5f67 7075 5f75 7469 _gromacs_gpu_uti\n-00018ee0: 6c73 3c2f 7469 746c 653e 0a3c 7061 7468 ls....\n-00019010: 0a3c 6720 6964 3d22 6564 6765 3135 3422 ..<\n-00019030: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00019040: 5f67 726f 6d61 6373 5f6d 6474 7970 6573 _gromacs_mdtypes\n-00019050: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-00019060: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n-00019070: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b....\n-000191d0: 0a3c 6720 6964 3d22 6564 6765 3135 3722 ..<\n-000191f0: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00019200: 5f67 726f 6d61 6373 5f6d 6474 7970 6573 _gromacs_mdtypes\n-00019210: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-00019220: 7372 635f 6772 6f6d 6163 735f 6669 6c65 src_gromacs_file\n-00019230: 696f 3c2f 7469 746c 653e 0a3c 7061 7468 io....\n-00019420: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..modul\n-00019490: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n-000194a0: 7479 7065 7326 2334 353b 2667 743b 6d6f types->mo\n-000194b0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-000194c0: 5f64 6f6d 6465 633c 2f74 6974 6c65 3e0a _domdec.\n-000194d0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .\n-00019580: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_src_gro\n-00019670: 6d61 6373 5f6d 6474 7970 6573 2623 3435 macs_mdtypes-\n-00019680: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00019690: 6772 6f6d 6163 735f 6577 616c 643c 2f74 gromacs_ewald......module_src_gro\n-00019850: 6d61 6373 5f6d 6474 7970 6573 2623 3435 macs_mdtypes-\n-00019860: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00019870: 6772 6f6d 6163 735f 6170 706c 6965 645f gromacs_applied_\n-00019880: 666f 7263 6573 5f61 7768 3c2f 7469 746c forces_awh......module\n-00019bf0: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n-00019c00: 7072 6570 726f 6365 7373 2623 3435 3b26 preprocess-&\n-00019c10: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-00019c20: 6f6d 6163 735f 6d64 7275 6e75 7469 6c69 omacs_mdrunutili\n-00019c30: 7479 3c2f 7469 746c 653e 0a3c 7061 7468 ty......module_src_gr\n-00019db0: 6f6d 6163 735f 676d 7870 7265 7072 6f63 omacs_gmxpreproc\n-00019dc0: 6573 7326 2334 353b 2667 743b 6d6f 6475 ess->modu\n-00019dd0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f72 le_src_gromacs_r\n-00019de0: 616e 646f 6d3c 2f74 6974 6c65 3e0a 3c70 andom....\n-00019f90: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..modu\n-0001a250: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n-0001a260: 6d78 7072 6570 726f 6365 7373 2623 3435 mxpreprocess-\n-0001a270: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-0001a280: 6772 6f6d 6163 735f 6f70 7469 6f6e 733c gromacs_options<\n-0001a290: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n-0001a2a0: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n-0001a2b0: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n-0001a2c0: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n-0001a2d0: 2220 643d 224d 3130 3031 2e39 392c 2d39 \" d=\"M1001.99,-9\n-0001a2e0: 3638 2e38 3943 3832 352e 3439 2c2d 3936 68.89C825.49,-96\n-0001a2f0: 302e 3638 2032 3935 2e39 332c 2d39 3335 0.68 295.93,-935\n-0001a300: 2e30 3920 3238 322e 3536 2c2d 3932 332e .09 282.56,-923.\n-0001a310: 3035 2032 3135 2e32 2c2d 3836 322e 3433 05 215.2,-862.43\n-0001a320: 2032 3438 2e35 362c 2d38 3132 2e36 3320 248.56,-812.63 \n-0001a330: 3234 382e 3536 2c2d 3732 322e 3031 2032 248.56,-722.01 2\n-0001a340: 3438 2e35 362c 2d37 3232 2e30 3120 3234 48.56,-722.01 24\n-0001a350: 382e 3536 2c2d 3732 322e 3031 2032 3438 8.56,-722.01 248\n-0001a360: 2e35 362c 2d36 3537 2e31 3420 3234 382e .56,-657.14 248.\n-0001a370: 3536 2c2d 3537 332e 3732 2032 3238 2e35 56,-573.72 228.5\n-0001a380: 362c 2d35 3533 2e39 3420 3232 382e 3536 6,-553.94 228.56\n-0001a390: 2c2d 3437 302e 3533 2032 3238 2e35 362c ,-470.53 228.56,\n-0001a3a0: 2d34 3730 2e35 3320 3232 382e 3536 2c2d -470.53 228.56,-\n-0001a3b0: 3437 302e 3533 2032 3238 2e35 362c 2d32 470.53 228.56,-2\n-0001a3c0: 3739 2e39 3220 3232 382e 3536 2c2d 3233 79.92 228.56,-23\n-0001a3d0: 362e 3834 2032 3535 2e30 342c 2d32 3330 6.84 255.04,-230\n-0001a3e0: 2e33 3720 3238 392e 3536 2c2d 3230 342e .37 289.56,-204.\n-0001a3f0: 3631 2033 3233 2e31 2c2d 3137 392e 3538 61 323.1,-179.58\n-0001a400: 2033 3432 2e31 392c 2d31 3932 2e34 3820 342.19,-192.48 \n-0001a410: 3337 362e 3536 2c2d 3136 382e 3631 2033 376.56,-168.61 3\n-0001a420: 3839 2e39 362c 2d31 3539 2e33 3120 3338 89.96,-159.31 38\n-0001a430: 392e 3538 2c2d 3135 322e 3831 2034 3031 9.58,-152.81 401\n-0001a440: 2e35 362c 2d31 3431 2e37 3420 3431 332e .56,-141.74 413.\n-0001a450: 3436 2c2d 3133 302e 3733 2034 3237 2e36 46,-130.73 427.6\n-0001a460: 2c2d 3131 392e 3431 2034 3339 2e32 362c ,-119.41 439.26,\n-0001a470: 2d31 3130 2e34 3922 2f3e 0a3c 706f 6c79 -110.49\"/>.<poly\n-0001a480: 676f 6e20 6669 6c6c 3d22 2332 3832 6663 gon fill=\"#282fc\n-0001a490: 6322 2073 7472 6f6b 653d 2223 3238 3266 c\" stroke=\"#282f\n-0001a4a0: 6363 2220 706f 696e 7473 3d22 3434 312e cc\" points=\"441.\n-0001a4b0: 3338 2c2d 3131 332e 3237 2034 3437 2e32 38,-113.27 447.2\n-0001a4c0: 352c 2d31 3034 2e34 3520 3433 372e 3136 5,-104.45 437.16\n-0001a4d0: 2c2d 3130 372e 3638 2034 3431 2e33 382c ,-107.68 441.38,\n-0001a4e0: 2d31 3133 2e32 3722 2f3e 0a3c 2f67 3e0a -113.27\"/>.</g>.\n-0001a4f0: 3c21 2d2d 206d 6f64 756c 655f 7372 635f <!-- module_src_\n-0001a500: 6772 6f6d 6163 735f 676d 7870 7265 7072 gromacs_gmxprepr\n-0001a510: 6f63 6573 7326 2334 353b 2667 743b 6d6f ocess->mo\n-0001a520: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0001a530: 5f66 6674 202d 2d3e 0a3c 6720 6964 3d22 _fft -->.<g id=\"\n-0001a540: 6564 6765 3136 3222 2063 6c61 7373 3d22 edge162\" class=\"\n-0001a550: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n-0001a560: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0001a570: 5f67 6d78 7072 6570 726f 6365 7373 2623 _gmxpreprocess&#\n-0001a580: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-0001a590: 635f 6772 6f6d 6163 735f 6666 743c 2f74 c_gromacs_fft</t\n-0001a5a0: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n-0001a5b0: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n-0001a5c0: 2362 6662 6662 6622 2064 3d22 4d31 3030 #bfbfbf\" d=\"M100\n-0001a5d0: 312e 3535 2c2d 3936 392e 3143 3934 352e 1.55,-969.1C945.\n-0001a5e0: 3039 2c2d 3936 342e 3936 2038 3537 2e32 09,-964.96 857.2\n-0001a5f0: 332c 2d39 3533 2e37 2037 3837 2e35 362c 3,-953.7 787.56,\n-0001a600: 2d39 3233 2e30 3520 3636 312e 3133 2c2d -923.05 661.13,-\n-0001a610: 3836 372e 3432 2036 3038 2e35 362c 2d38 867.42 608.56,-8\n-0001a620: 3534 2e36 3620 3534 302e 3536 2c2d 3733 54.66 540.56,-73\n-0001a630: 342e 3434 2035 3038 2e31 342c 2d36 3737 4.44 508.14,-677\n-0001a640: 2e31 3320 3531 332e 3631 2c2d 3539 352e .13 513.61,-595.\n-0001a650: 3634 2035 3138 2e38 322c 2d35 3536 2e33 64 518.82,-556.3\n-0001a660: 3422 2f3e 0a3c 706f 6c79 676f 6e20 6669 4\"/>.<polygon fi\n-0001a670: 6c6c 3d22 2362 6662 6662 6622 2073 7472 ll=\"#bfbfbf\" str\n-0001a680: 6f6b 653d 2223 6266 6266 6266 2220 706f oke=\"#bfbfbf\" po\n-0001a690: 696e 7473 3d22 3532 322e 3332 2c2d 3535 ints=\"522.32,-55\n-0001a6a0: 362e 3631 2035 3230 2e32 382c 2d35 3436 6.61 520.28,-546\n-0001a6b0: 2e32 3220 3531 352e 3339 2c2d 3535 352e .22 515.39,-555.\n-0001a6c0: 3631 2035 3232 2e33 322c 2d35 3536 2e36 61 522.32,-556.6\n-0001a6d0: 3122 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 1\"/>.</g>.<!-- m\n-0001a6e0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001a6f0: 735f 676d 7870 7265 7072 6f63 6573 7326 s_gmxpreprocess&\n-0001a700: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-0001a710: 7263 5f67 726f 6d61 6373 5f6d 6472 756e rc_gromacs_mdrun\n-0001a720: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n-0001a730: 3136 3522 2063 6c61 7373 3d22 6564 6765 165\" class=\"edge\n-0001a740: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n-0001a750: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n-0001a760: 7072 6570 726f 6365 7373 2623 3435 3b26 preprocess-&\n-0001a770: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001a780: 6f6d 6163 735f 6d64 7275 6e3c 2f74 6974 omacs_mdrun</tit\n-0001a790: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-0001a7a0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n-0001a7b0: 3832 6663 6322 2073 7472 6f6b 652d 6461 82fcc\" stroke-da\n-0001a7c0: 7368 6172 7261 793d 2235 2c32 2220 643d sharray=\"5,2\" d=\n-0001a7d0: 224d 3130 3635 2e34 322c 2d39 3538 2e37 \"M1065.42,-958.7\n-0001a7e0: 3543 3130 3730 2e36 372c 2d39 3438 2e39 5C1070.67,-948.9\n-0001a7f0: 3820 3130 3738 2e30 382c 2d39 3335 2e31 8 1078.08,-935.1\n-0001a800: 3720 3130 3834 2e35 362c 2d39 3233 2e30 7 1084.56,-923.0\n-0001a810: 3520 3131 3530 2e35 382c 2d37 3939 2e34 5 1150.58,-799.4\n-0001a820: 3720 3131 3336 2e34 322c 2d37 3436 2e36 7 1136.42,-746.6\n-0001a830: 3220 3132 3332 2e35 362c 2d36 3434 2e37 2 1232.56,-644.7\n-0001a840: 2031 3330 382e 3538 2c2d 3536 342e 3131 1308.58,-564.11\n-0001a850: 2031 3432 392e 3839 2c2d 3530 362e 3939 1429.89,-506.99\n-0001a860: 2031 3438 362e 3935 2c2d 3438 332e 3035 1486.95,-483.05\n-0001a870: 222f 3e0a 3c70 6f6c 7967 6f6e 2066 696c \"/>.<polygon fil\n-0001a880: 6c3d 2223 3238 3266 6363 2220 7374 726f l=\"#282fcc\" stro\n-0001a890: 6b65 3d22 2332 3832 6663 6322 2070 6f69 ke=\"#282fcc\" poi\n-0001a8a0: 6e74 733d 2231 3438 382e 362c 2d34 3836 nts=\"1488.6,-486\n-0001a8b0: 2e31 3620 3134 3936 2e35 312c 2d34 3739 .16 1496.51,-479\n-0001a8c0: 2e31 2031 3438 352e 3933 2c2d 3437 392e .1 1485.93,-479.\n-0001a8d0: 3639 2031 3438 382e 362c 2d34 3836 2e31 69 1488.6,-486.1\n-0001a8e0: 3622 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6\"/>.</g>.<!-- m\n-0001a8f0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001a900: 735f 676d 7870 7265 7072 6f63 6573 7326 s_gmxpreprocess&\n-0001a910: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-0001a920: 7263 5f67 726f 6d61 6373 5f69 6d64 202d rc_gromacs_imd -\n-0001a930: 2d3e 0a3c 6720 6964 3d22 6564 6765 3136 ->.<g id=\"edge16\n-0001a940: 3322 2063 6c61 7373 3d22 6564 6765 223e 3\" class=\"edge\">\n-0001a950: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n-0001a960: 7263 5f67 726f 6d61 6373 5f67 6d78 7072 rc_gromacs_gmxpr\n-0001a970: 6570 726f 6365 7373 2623 3435 3b26 6774 eprocess->\n-0001a980: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-0001a990: 6163 735f 696d 643c 2f74 6974 6c65 3e0a acs_imd.\n-0001a9a0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 \n-0001aa80: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....module\n-0001ab70: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n-0001ab80: 7072 6570 726f 6365 7373 2623 3435 3b26 preprocess-&\n-0001ab90: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001aba0: 6f6d 6163 735f 676d 7861 6e61 3c2f 7469 omacs_gmxana</ti\n-0001abb0: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-0001abc0: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-0001abd0: 6266 6266 6266 2220 643d 224d 3130 3037 bfbfbf\" d=\"M1007\n-0001abe0: 2e32 372c 2d39 3635 2e39 3143 3934 352e .27,-965.91C945.\n-0001abf0: 3937 2c2d 3935 382e 3434 2038 3437 2e38 97,-958.44 847.8\n-0001ac00: 342c 2d39 3433 2e37 2038 3137 2e35 362c 4,-943.7 817.56,\n-0001ac10: 2d39 3233 2e30 3520 3737 352e 3431 2c2d -923.05 775.41,-\n-0001ac20: 3839 342e 3331 2037 3438 2e37 322c 2d38 894.31 748.72,-8\n-0001ac30: 3338 2e33 3220 3733 362e 3436 2c2d 3830 38.32 736.46,-80\n-0001ac40: 372e 3136 222f 3e0a 3c70 6f6c 7967 6f6e 7.16\"/>.<polygon\n-0001ac50: 2066 696c 6c3d 2223 6266 6266 6266 2220 fill=\"#bfbfbf\" \n-0001ac60: 7374 726f 6b65 3d22 2362 6662 6662 6622 stroke=\"#bfbfbf\"\n-0001ac70: 2070 6f69 6e74 733d 2237 3339 2e36 362c points=\"739.66,\n-0001ac80: 2d38 3035 2e37 3320 3733 322e 3835 2c2d -805.73 732.85,-\n-0001ac90: 3739 372e 3632 2037 3333 2e31 322c 2d38 797.62 733.12,-8\n-0001aca0: 3038 2e32 3120 3733 392e 3636 2c2d 3830 08.21 739.66,-80\n-0001acb0: 352e 3733 222f 3e0a 3c2f 673e 0a3c 212d 5.73\"/>.</g>.<!-\n-0001acc0: 2d20 6d6f 6475 6c65 5f73 7263 5f67 726f - module_src_gro\n-0001acd0: 6d61 6373 5f67 6d78 7072 6570 726f 6365 macs_gmxpreproce\n-0001ace0: 7373 2623 3435 3b26 6774 3b6d 6f64 756c ss->modul\n-0001acf0: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n-0001ad00: 786c 6962 202d 2d3e 0a3c 6720 6964 3d22 xlib -->.<g id=\"\n-0001ad10: 6564 6765 3137 3022 2063 6c61 7373 3d22 edge170\" class=\"\n-0001ad20: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n-0001ad30: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0001ad40: 5f67 6d78 7072 6570 726f 6365 7373 2623 _gmxpreprocess&#\n-0001ad50: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-0001ad60: 635f 6772 6f6d 6163 735f 676d 786c 6962 c_gromacs_gmxlib\n-0001ad70: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 .\n-0001ae90: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....modul\n-0001af80: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n-0001af90: 7870 7265 7072 6f63 6573 7326 2334 353b xpreprocess-\n-0001afa0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0001afb0: 726f 6d61 6373 5f6d 6474 7970 6573 3c2f romacs_mdtypes</\n-0001afc0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-0001afd0: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-0001afe0: 2223 6266 6266 6266 2220 643d 224d 3130 \"#bfbfbf\" d=\"M10\n-0001aff0: 3837 2e32 362c 2d39 3630 2e36 3143 3131 87.26,-960.61C11\n-0001b000: 3933 2e39 372c 2d39 3230 2e31 3420 3135 93.97,-920.14 15\n-0001b010: 3637 2e36 362c 2d37 3738 2e34 3620 3136 67.66,-778.46 16\n-0001b020: 3832 2e36 342c 2d37 3334 2e38 3722 2f3e 82.64,-734.87\"/>\n-0001b030: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .<polygon fill=\"\n-0001b040: 2362 6662 6662 6622 2073 7472 6f6b 653d #bfbfbf\" stroke=\n-0001b050: 2223 6266 6266 6266 2220 706f 696e 7473 \"#bfbfbf\" points\n-0001b060: 3d22 3136 3833 2e39 312c 2d37 3338 2e31 =\"1683.91,-738.1\n-0001b070: 3320 3136 3932 2e30 322c 2d37 3331 2e33 3 1692.02,-731.3\n-0001b080: 3120 3136 3831 2e34 332c 2d37 3331 2e35 1 1681.43,-731.5\n-0001b090: 3820 3136 3833 2e39 312c 2d37 3338 2e31 8 1683.91,-738.1\n-0001b0a0: 3322 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 3\"/>.</g>.<!-- m\n-0001b0b0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001b0c0: 735f 676d 7870 7265 7072 6f63 6573 7326 s_gmxpreprocess&\n-0001b0d0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-0001b0e0: 7263 5f67 726f 6d61 6373 5f6d 646c 6962 rc_gromacs_mdlib\n-0001b0f0: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n-0001b100: 3136 3422 2063 6c61 7373 3d22 6564 6765 164\" class=\"edge\n-0001b110: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n-0001b120: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n-0001b130: 7072 6570 726f 6365 7373 2623 3435 3b26 preprocess-&\n-0001b140: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001b150: 6f6d 6163 735f 6d64 6c69 623c 2f74 6974 omacs_mdlib</tit\n-0001b160: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-0001b170: 6e6f 6e65 2220 7374 726f 6b65 3d22 2362 none\" stroke=\"#b\n-0001b180: 6662 6662 6622 2064 3d22 4d31 3039 302e fbfbf\" d=\"M1090.\n-0001b190: 3139 2c2d 3936 312e 3136 4331 3131 322e 19,-961.16C1112.\n-0001b1a0: 3336 2c2d 3935 322e 3938 2031 3134 312e 36,-952.98 1141.\n-0001b1b0: 3934 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2031 3439 86.7,-678.88 149\n-0001b2a0: 322e 3439 2c2d 3637 3020 3134 3832 2e34 2.49,-670 1482.4\n-0001b2b0: 332c 2d36 3733 2e33 3320 3134 3836 2e37 3,-673.33 1486.7\n-0001b2c0: 2c2d 3637 382e 3838 222f 3e0a 3c2f 673e ,-678.88\"/>.</g>\n-0001b2d0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 .<!-- module_src\n-0001b2e0: 5f67 726f 6d61 6373 5f67 6d78 7072 6570 _gromacs_gmxprep\n-0001b2f0: 726f 6365 7373 2623 3435 3b26 6774 3b6d rocess->m\n-0001b300: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001b310: 735f 6669 6c65 696f 202d 2d3e 0a3c 6720 s_fileio -->.<g \n-0001b320: 6964 3d22 6564 6765 3135 3922 2063 6c61 id=\"edge159\" cla\n-0001b330: 7373 3d22 6564 6765 223e 0a3c 7469 746c ss=\"edge\">.<titl\n-0001b340: 653e 6d6f 6475 6c65 5f73 7263 5f67 726f e>module_src_gro\n-0001b350: 6d61 6373 5f67 6d78 7072 6570 726f 6365 macs_gmxpreproce\n-0001b360: 7373 2623 3435 3b26 6774 3b6d 6f64 756c ss->modul\n-0001b370: 655f 7372 635f 6772 6f6d 6163 735f 6669 e_src_gromacs_fi\n-0001b380: 6c65 696f 3c2f 7469 746c 653e 0a3c 7061 leio......modul\n-0001b560: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n-0001b570: 7870 7265 7072 6f63 6573 7326 2334 353b xpreprocess-\n-0001b580: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0001b590: 726f 6d61 6373 5f64 6f6d 6465 633c 2f74 romacs_domdec</t\n-0001b5a0: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n-0001b5b0: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n-0001b5c0: 2332 3832 6663 6322 2073 7472 6f6b 652d #282fcc\" stroke-\n-0001b5d0: 6461 7368 6172 7261 793d 2235 2c32 2220 dasharray=\"5,2\" \n-0001b5e0: 643d 224d 3131 3132 2e34 372c 2d39 3637 d=\"M1112.47,-967\n-0001b5f0: 2e31 3243 3132 3030 2e37 312c 2d39 3539 .12C1200.71,-959\n-0001b600: 2e37 3120 3133 3831 2e33 372c 2d39 3433 .71 1381.37,-943\n-0001b610: 2e34 3920 3135 3333 2e35 362c 2d39 3233 .49 1533.56,-923\n-0001b620: 2e30 3520 3136 3035 2e34 362c 2d39 3133 .05 1605.46,-913\n-0001b630: 2e34 2031 3632 322e 3634 2c2d 3930 352e 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6173 6b61 7373 6967 6e6d 656e 7426 _taskassignment&\n+00009030: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00009040: 7263 5f67 726f 6d61 6373 5f6d 646c 6962 rc_gromacs_mdlib\n+00009050: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 .\n+00009120: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....modul\n+00009210: 655f 7372 635f 6772 6f6d 6163 735f 7461 e_src_gromacs_ta\n+00009220: 736b 6173 7369 676e 6d65 6e74 2623 3435 skassignment-\n+00009230: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00009240: 6772 6f6d 6163 735f 646f 6d64 6563 3c2f gromacs_domdec</\n+00009250: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+00009260: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+00009270: 2223 3238 3266 6363 2220 7374 726f 6b65 \"#282fcc\" stroke\n+00009280: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n+00009290: 2064 3d22 4d31 3835 382e 3136 2c2d 3335 d=\"M1858.16,-35\n+000092a0: 372e 3432 4331 3837 342e 3433 2c2d 3337 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ule_src_gromacs_\n+0000a8d0: 6d64 7275 6e26 2334 353b 2667 743b 6d6f mdrun->mo\n+0000a8e0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000a8f0: 5f68 6172 6477 6172 6520 2d2d 3e0a 3c67 _hardware -->.<g\n+0000a900: 2069 643d 2265 6467 6537 3822 2063 6c61 id=\"edge78\" cla\n+0000a910: 7373 3d22 6564 6765 223e 0a3c 7469 746c ss=\"edge\">.<titl\n+0000a920: 653e 6d6f 6475 6c65 5f73 7263 5f67 726f e>module_src_gro\n+0000a930: 6d61 6373 5f6d 6472 756e 2623 3435 3b26 macs_mdrun-&\n+0000a940: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+0000a950: 6f6d 6163 735f 6861 7264 7761 7265 3c2f omacs_hardware</\n+0000a960: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+0000a970: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+0000a980: 2223 6266 6266 6266 2220 643d 224d 3135 \"#bfbfbf\" d=\"M15\n+0000a990: 3439 2e31 352c 2d34 3139 2e38 3343 3135 49.15,-419.83C15\n+0000a9a0: 3734 2e34 372c 2d34 3531 2e37 3620 3136 74.47,-451.76 16\n+0000a9b0: 3435 2e36 332c 2d35 3430 2e31 3920 3137 45.63,-540.19 17\n+0000a9c0: 3130 2e35 362c 2d36 3038 2e37 2031 3732 10.56,-608.7 172\n+0000a9d0: 362e 3536 2c2d 3632 352e 3539 2031 3733 6.56,-625.59 173\n+0000a9e0: 352e 3738 2c2d 3632 352e 3236 2031 3734 5.78,-625.26 174\n+0000a9f0: 382e 3536 2c2d 3634 342e 3720 3137 3634 8.56,-644.7 1764\n+0000aa00: 2e39 2c2d 3636 392e 3536 2031 3736 352e .9,-669.56 1765.\n+0000aa10: 3037 2c2d 3637 382e 3533 2031 3737 312e 07,-678.53 1771.\n+0000aa20: 3536 2c2d 3730 372e 3537 2031 3738 302e 56,-707.57 1780.\n+0000aa30: 3239 2c2d 3734 362e 3635 2031 3737 302e 29,-746.65 1770.\n+0000aa40: 3635 2c2d 3735 382e 3237 2031 3737 392e 65,-758.27 1779.\n+0000aa50: 3536 2c2d 3739 372e 3331 2031 3739 392e 56,-797.31 1799.\n+0000aa60: 352c 2d38 3834 2e36 3320 3137 3739 2e34 5,-884.63 1779.4\n+0000aa70: 372c 2d39 3331 2e34 3320 3138 3530 2e35 7,-931.43 1850.5\n+0000aa80: 362c 2d39 3835 2e39 3220 3139 3135 2e39 6,-985.92 1915.9\n+0000aa90: 352c 2d31 3033 362e 3034 2032 3133 382e 5,-1036.04 2138.\n+0000aaa0: 3433 2c2d 3130 3037 2e35 3520 3232 3139 43,-1007.55 2219\n+0000aab0: 2e35 362c 2d31 3032 312e 3932 2032 3232 .56,-1021.92 222\n+0000aac0: 322e 362c 2d31 3032 322e 3436 2032 3232 2.6,-1022.46 222\n+0000aad0: 352e 3733 2c2d 3130 3233 2e30 3920 3232 5.73,-1023.09 22\n+0000aae0: 3238 2e38 362c 2d31 3032 332e 3738 222f 28.86,-1023.78\"/\n+0000aaf0: 3e0a 3c70 6f6c 7967 6f6e 2066 696c 6c3d >.<polygon fill=\n+0000ab00: 2223 6266 6266 6266 2220 7374 726f 6b65 \"#bfbfbf\" stroke\n+0000ab10: 3d22 2362 6662 6662 6622 2070 6f69 6e74 =\"#bfbfbf\" point\n+0000ab20: 733d 2232 3232 382e 3235 2c2d 3130 3237 s=\"2228.25,-1027\n+0000ab30: 2e32 3320 3232 3338 2e37 382c 2d31 3032 .23 2238.78,-102\n+0000ab40: 362e 3132 2032 3232 392e 3836 2c2d 3130 6.12 2229.86,-10\n+0000ab50: 3230 2e34 3220 3232 3238 2e32 352c 2d31 20.42 2228.25,-1\n+0000ab60: 3032 372e 3233 222f 3e0a 3c2f 673e 0a3c 027.23\"/>.</g>.<\n+0000ab70: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+0000ab80: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n+0000ab90: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0000aba0: 6772 6f6d 6163 735f 6c69 7374 6564 5f66 gromacs_listed_f\n+0000abb0: 6f72 6365 7320 2d2d 3e0a 3c67 2069 643d orces -->.<g id=\n+0000abc0: 2265 6467 6536 3922 2063 6c61 7373 3d22 \"edge69\" class=\"\n+0000abd0: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n+0000abe0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000abf0: 5f6d 6472 756e 2623 3435 3b26 6774 3b6d _mdrun->m\n+0000ac00: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000ac10: 735f 6c69 7374 6564 5f66 6f72 6365 733c s_listed_forces<\n+0000ac20: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+0000ac30: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+0000ac40: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+0000ac50: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n+0000ac60: 2220 643d 224d 3135 3730 2e33 352c 2d34 \" d=\"M1570.35,-4\n+0000ac70: 3034 2e34 3643 3136 3639 2e36 312c 2d34 04.46C1669.61,-4\n+0000ac80: 3030 2e33 3220 3139 3736 2e36 392c 2d33 00.32 1976.69,-3\n+0000ac90: 3835 2e33 3620 3230 3130 2e35 362c 2d33 85.36 2010.56,-3\n+0000aca0: 3537 2e32 3220 3230 3634 2e39 352c 2d33 57.22 2064.95,-3\n+0000acb0: 3132 2e30 3320 3230 3039 2e39 342c 2d32 12.03 2009.94,-2\n+0000acc0: 3538 2e36 3420 3230 3535 2e35 362c 2d32 58.64 2055.56,-2\n+0000acd0: 3034 2e36 3120 3230 3639 2e38 322c 2d31 04.61 2069.82,-1\n+0000ace0: 3837 2e37 3320 3230 3931 2e33 362c 2d31 87.73 2091.36,-1\n+0000acf0: 3736 2e32 3220 3231 3130 2e37 312c 2d31 76.22 2110.71,-1\n+0000ad00: 3638 2e36 3722 2f3e 0a3c 706f 6c79 676f 68.67\"/>.<polygo\n+0000ad10: 6e20 6669 6c6c 3d22 2332 3832 6663 6322 n fill=\"#282fcc\"\n+0000ad20: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n+0000ad30: 2220 706f 696e 7473 3d22 3231 3132 2e30 \" points=\"2112.0\n+0000ad40: 392c 2d31 3731 2e39 2032 3132 302e 3239 9,-171.9 2120.29\n+0000ad50: 2c2d 3136 352e 3138 2032 3130 392e 3639 ,-165.18 2109.69\n+0000ad60: 2c2d 3136 352e 3332 2032 3131 322e 3039 ,-165.32 2112.09\n+0000ad70: 2c2d 3137 312e 3922 2f3e 0a3c 2f67 3e0a ,-171.9\"/>.</g>.\n+0000ad80: 3c21 2d2d 206d 6f64 756c 655f 7372 635f <!-- module_src_\n+0000ad90: 6772 6f6d 6163 735f 6d64 7275 6e26 2334 gromacs_mdrun\n+0000ada0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+0000adb0: 5f67 726f 6d61 6373 5f6e 626e 786d 202d _gromacs_nbnxm -\n+0000adc0: 2d3e 0a3c 6720 6964 3d22 6564 6765 3737 ->.<g id=\"edge77\n+0000add0: 2220 636c 6173 733d 2265 6467 6522 3e0a \" class=\"edge\">.\n+0000ade0: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 <title>module_sr\n+0000adf0: 635f 6772 6f6d 6163 735f 6d64 7275 6e26 c_gromacs_mdrun&\n+0000ae00: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+0000ae10: 7263 5f67 726f 6d61 6373 5f6e 626e 786d rc_gromacs_nbnxm\n+0000ae20: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......module_src_grom\n+0000aff0: 6163 735f 6d64 7275 6e26 2334 353b 2667 acs_mdrun-&g\n+0000b000: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+0000b010: 6d61 6373 5f6f 7074 696f 6e73 3c2f 7469 macs_options....<\n+0000b120: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+0000b130: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n+0000b140: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0000b150: 6772 6f6d 6163 735f 7461 736b 6173 7369 gromacs_taskassi\n+0000b160: 676e 6d65 6e74 202d 2d3e 0a3c 6720 6964 gnment -->..m\n+0000b190: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000b1a0: 735f 6d64 7275 6e26 2334 353b 2667 743b s_mdrun->\n+0000b1b0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000b1c0: 6373 5f74 6173 6b61 7373 6967 6e6d 656e cs_taskassignmen\n+0000b1d0: 743c 2f74 6974 6c65 3e0a 3c70 6174 6820 t..\n+0000b240: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2272 ..<\n+0000b2b0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+0000b2c0: 726f 6d61 6373 5f69 6d64 202d 2d3e 0a3c romacs_imd -->.<\n+0000b2d0: 6720 6964 3d22 6e6f 6465 3231 2220 636c g id=\"node21\" cl\n+0000b2e0: 6173 733d 226e 6f64 6522 3e0a 3c74 6974 ass=\"node\">.module_src_gr\n+0000b300: 6f6d 6163 735f 696d 643c 2f74 6974 6c65 omacs_imd...imd\n+0000b420: 3c2f 7465 7874 3e0a 3c2f 613e 0a3c 2f67 ......modu\n+0000b4a0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+0000b4b0: 6472 756e 2623 3435 3b26 6774 3b6d 6f64 drun->mod\n+0000b4c0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0000b4d0: 696d 643c 2f74 6974 6c65 3e0a 3c70 6174 imd....\n+0000b640: 0a3c 6720 6964 3d22 6564 6765 3637 2220 ..module_src_\n+0000b670: 6772 6f6d 6163 735f 6d64 7275 6e26 2334 gromacs_mdrun\n+0000b680: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+0000b690: 5f67 726f 6d61 6373 5f67 6d78 6c69 623c _gromacs_gmxlib<\n+0000b6a0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>..\n+0000b7a0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_src_grom\n+0000b890: 6163 735f 6d64 7275 6e26 2334 353b 2667 acs_mdrun-&g\n+0000b8a0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+0000b8b0: 6d61 6373 5f63 6f6d 7061 743c 2f74 6974 macs_compat....\n+0000ba30: 0a3c 6720 6964 3d22 6564 6765 3539 2220 ..module_src_\n+0000ba60: 6772 6f6d 6163 735f 6d64 7275 6e26 2334 gromacs_mdrun\n+0000ba70: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+0000ba80: 5f67 726f 6d61 6373 5f6d 6474 7970 6573 _gromacs_mdtypes\n+0000ba90: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......mo\n+0000bc90: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000bca0: 5f6d 6472 756e 2623 3435 3b26 6774 3b6d _mdrun->m\n+0000bcb0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000bcc0: 735f 6d64 6c69 623c 2f74 6974 6c65 3e0a s_mdlib.\n+0000bcd0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .\n+0000be00: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....mo\n+0000be70: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000be80: 5f6d 6472 756e 2623 3435 3b26 6774 3b6d _mdrun->m\n+0000be90: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000bea0: 735f 6669 6c65 696f 3c2f 7469 746c 653e s_fileio\n+0000beb0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....<\n+0000bff0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+0000c000: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n+0000c010: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0000c020: 6772 6f6d 6163 735f 646f 6d64 6563 202d gromacs_domdec -\n+0000c030: 2d3e 0a3c 6720 6964 3d22 6564 6765 3634 ->..\n+0000c050: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 module_sr\n+0000c060: 635f 6772 6f6d 6163 735f 6d64 7275 6e26 c_gromacs_mdrun&\n+0000c070: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+0000c080: 7263 5f67 726f 6d61 6373 5f64 6f6d 6465 rc_gromacs_domde\n+0000c090: 633c 2f74 6974 6c65 3e0a 3c70 6174 6820 c......module_\n+0000c1f0: 7372 635f 6772 6f6d 6163 735f 6d64 7275 src_gromacs_mdru\n+0000c200: 6e26 2334 353b 2667 743b 6d6f 6475 6c65 n->module\n+0000c210: 5f73 7263 5f67 726f 6d61 6373 5f63 6f6d _src_gromacs_com\n+0000c220: 6d61 6e64 6c69 6e65 3c2f 7469 746c 653e mandline\n+0000c230: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ...<\n+0000c340: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>..<\n+0000c370: 6720 6964 3d22 6e6f 6465 3337 2220 636c g id=\"node37\" cl\n+0000c380: 6173 733d 226e 6f64 6522 3e0a 3c74 6974 ass=\"node\">.module_src_gr\n+0000c3a0: 6f6d 6163 735f 6170 706c 6965 645f 666f omacs_applied_fo\n+0000c3b0: 7263 6573 3c2f 7469 746c 653e 0a3c 656c rces..applied_forces\n+0000c480: 3c2f 7465 7874 3e0a 3c2f 673e 0a3c 212d ....mod\n+0000c500: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0000c510: 6d64 7275 6e26 2334 353b 2667 743b 6d6f mdrun->mo\n+0000c520: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000c530: 5f61 7070 6c69 6564 5f66 6f72 6365 733c _applied_forces<\n+0000c540: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+0000c550: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+0000c560: 3d22 7265 6422 2064 3d22 4d31 3531 312e =\"red\" d=\"M1511.\n+0000c570: 3339 2c2d 3430 302e 3838 4331 3435 312e 39,-400.88C1451.\n+0000c580: 3833 2c2d 3339 302e 3738 2031 3331 322e 83,-390.78 1312.\n+0000c590: 3235 2c2d 3336 372e 3131 2031 3233 342e 25,-367.11 1234.\n+0000c5a0: 3738 2c2d 3335 332e 3938 222f 3e0a 3c70 78,-353.98\"/>.<p\n+0000c5b0: 6f6c 7967 6f6e 2066 696c 6c3d 2272 6564 olygon fill=\"red\n+0000c5c0: 2220 7374 726f 6b65 3d22 7265 6422 2070 \" stroke=\"red\" p\n+0000c5d0: 6f69 6e74 733d 2231 3233 352e 3138 2c2d oints=\"1235.18,-\n+0000c5e0: 3335 302e 3520 3132 3234 2e37 332c 2d33 350.5 1224.73,-3\n+0000c5f0: 3532 2e32 3720 3132 3334 2e30 312c 2d33 52.27 1234.01,-3\n+0000c600: 3537 2e34 2031 3233 352e 3138 2c2d 3335 57.4 1235.18,-35\n+0000c610: 302e 3522 2f3e 0a3c 2f67 3e0a 3c21 2d2d 0.5\"/>.</g>.<!--\n+0000c620: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n+0000c630: 6163 735f 7265 7374 7261 696e 7420 2d2d acs_restraint --\n+0000c640: 3e0a 3c67 2069 643d 226e 6f64 6533 3822 >.<g id=\"node38\"\n+0000c650: 2063 6c61 7373 3d22 6e6f 6465 223e 0a3c class=\"node\">.<\n+0000c660: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+0000c670: 5f67 726f 6d61 6373 5f72 6573 7472 6169 _gromacs_restrai\n+0000c680: 6e74 3c2f 7469 746c 653e 0a3c 6720 6964 nt...restraint...<\n+0000c7c0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...m\n+0000c830: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000c840: 735f 6d64 7275 6e26 2334 353b 2667 743b s_mdrun->\n+0000c850: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000c860: 6373 5f72 6573 7472 6169 6e74 3c2f 7469 cs_restraint</ti\n+0000c870: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n+0000c880: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n+0000c890: 3238 3266 6363 2220 7374 726f 6b65 2d64 282fcc\" stroke-d\n+0000c8a0: 6173 6861 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\n+0000cfc0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000cfd0: 6373 5f6d 6f64 756c 6172 7369 6d75 6c61 cs_modularsimula\n+0000cfe0: 746f 7220 2d2d 3e0a 3c67 2069 643d 226e tor -->.<g id=\"n\n+0000cff0: 6f64 6534 3522 2063 6c61 7373 3d22 6e6f ode45\" class=\"no\n+0000d000: 6465 223e 0a3c 7469 746c 653e 6d6f 6475 de\">.<title>modu\n+0000d010: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+0000d020: 6f64 756c 6172 7369 6d75 6c61 746f 723c odularsimulator<\n+0000d030: 2f74 6974 6c65 3e0a 3c67 2069 643d 2261 /title>.<g id=\"a\n+0000d040: 5f6e 6f64 6534 3522 3e3c 6120 786c 696e _node45\"><a xlin\n+0000d050: 6b3a 6872 6566 3d22 6772 6f75 705f 5f6d k:href=\"group__m\n+0000d060: 6f64 756c 655f 5f6d 6f64 756c 6172 7369 odule__modularsi\n+0000d070: 6d75 6c61 746f 722e 7868 746d 6c22 2074 mulator.xhtml\" t\n+0000d080: 6172 6765 743d 225f 746f 7022 2078 6c69 arget=\"_top\" xli\n+0000d090: 6e6b 3a74 6974 6c65 3d22 6d6f 6475 6c61 nk:title=\"modula\n+0000d0a0: 7273 696d 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0a3c 212d 2d20 6d6f /g>.</g>.<!-- mo\n+0000d190: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000d1a0: 5f6d 6472 756e 2623 3435 3b26 6774 3b6d _mdrun->m\n+0000d1b0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000d1c0: 735f 6d6f 6475 6c61 7273 696d 756c 6174 s_modularsimulat\n+0000d1d0: 6f72 202d 2d3e 0a3c 6720 6964 3d22 6564 or -->.<g id=\"ed\n+0000d1e0: 6765 3735 2220 636c 6173 733d 2265 6467 ge75\" class=\"edg\n+0000d1f0: 6522 3e0a 3c74 6974 6c65 3e6d 6f64 756c e\">.<title>modul\n+0000d200: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n+0000d210: 7275 6e26 2334 353b 2667 743b 6d6f 6475 run->modu\n+0000d220: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+0000d230: 6f64 756c 6172 7369 6d75 6c61 746f 723c odularsimulator<\n+0000d240: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+0000d250: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+0000d260: 3d22 7265 6422 2064 3d22 4d31 3535 372e =\"red\" 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636c 6173 733d 226e 6f64 6522 3e0a 3c74 class=\"node\">.<t\n+0000d360: 6974 6c65 3e6d 6f64 756c 655f 7372 635f itle>module_src_\n+0000d370: 6772 6f6d 6163 735f 7075 6c6c 696e 673c gromacs_pulling<\n+0000d380: 2f74 6974 6c65 3e0a 3c65 6c6c 6970 7365 /title>.<ellipse\n+0000d390: 2066 696c 6c3d 2223 6266 6266 6266 2220 fill=\"#bfbfbf\" \n+0000d3a0: 7374 726f 6b65 3d22 626c 6163 6b22 2063 stroke=\"black\" c\n+0000d3b0: 783d 2231 3439 302e 3536 2220 6379 3d22 x=\"1490.56\" cy=\"\n+0000d3c0: 2d35 3332 2e34 2220 7278 3d22 3331 2e32 -532.4\" rx=\"31.2\n+0000d3d0: 3322 2072 793d 2231 332e 3337 222f 3e0a 3\" ry=\"13.37\"/>.\n+0000d3e0: 3c74 6578 7420 7465 7874 2d61 6e63 686f <text text-ancho\n+0000d3f0: 723d 226d 6964 646c 6522 2078 3d22 3134 r=\"middle\" x=\"14\n+0000d400: 3930 2e35 3622 2079 3d22 2d35 3239 2e39 90.56\" y=\"-529.9\n+0000d410: 2220 666f 6e74 2d66 616d 696c 793d 2246 \" font-family=\"F\n+0000d420: 7265 6553 616e 7322 2066 6f6e 742d 7369 reeSans\" font-si\n+0000d430: 7a65 3d22 3130 2e30 3022 3e70 756c 6c69 ze=\"10.00\">pulli\n+0000d440: 6e67 3c2f 7465 7874 3e0a 3c2f 673e 0a3c ng</text>.</g>.<\n+0000d450: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+0000d460: 726f 6d61 6373 5f6d 6472 756e 2623 3435 romacs_mdrun-\n+0000d470: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0000d480: 6772 6f6d 6163 735f 7075 6c6c 696e 6720 gromacs_pulling \n+0000d490: 2d2d 3e0a 3c67 2069 643d 2265 6467 6537 -->.<g id=\"edge7\n+0000d4a0: 3222 2063 6c61 7373 3d22 6564 6765 223e 2\" class=\"edge\">\n+0000d4b0: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n+0000d4c0: 7263 5f67 726f 6d61 6373 5f6d 6472 756e rc_gromacs_mdrun\n+0000d4d0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+0000d4e0: 7372 635f 6772 6f6d 6163 735f 7075 6c6c src_gromacs_pull\n+0000d4f0: 696e 673c 2f74 6974 6c65 3e0a 3c70 6174 ing...\n+0000d5f0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ..\n+0000d640: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n+0000d650: 7263 5f67 726f 6d61 6373 5f61 7070 6c69 rc_gromacs_appli\n+0000d660: 6564 5f66 6f72 6365 735f 6177 683c 2f74 ed_forces_awh</t\n+0000d670: 6974 6c65 3e0a 3c67 2069 643d 2261 5f6e itle>.<g id=\"a_n\n+0000d680: 6f64 6534 3822 3e3c 6120 786c 696e 6b3a ode48\"><a xlink:\n+0000d690: 6872 6566 3d22 6772 6f75 705f 5f6d 6f64 href=\"group__mod\n+0000d6a0: 756c 655f 5f61 7768 2e78 6874 6d6c 2220 ule__awh.xhtml\" \n+0000d6b0: 7461 7267 6574 3d22 5f74 6f70 2220 786c target=\"_top\" xl\n+0000d6c0: 696e 6b3a 7469 746c 653d 2261 7768 223e ink:title=\"awh\">\n+0000d6d0: 0a3c 656c 6c69 7073 6520 6669 6c6c 3d22 .<ellipse fill=\"\n+0000d6e0: 6e6f 6e65 2220 7374 726f 6b65 3d22 626c none\" stroke=\"bl\n+0000d6f0: 6163 6b22 2063 783d 2236 3334 2e35 3622 ack\" cx=\"634.56\"\n+0000d700: 2063 793d 222d 3834 362e 3735 2220 7278 cy=\"-846.75\" rx\n+0000d710: 3d22 3237 2220 7279 3d22 3133 2e33 3722 =\"27\" ry=\"13.37\"\n+0000d720: 2f3e 0a3c 7465 7874 2074 6578 742d 616e />.<text text-an\n+0000d730: 6368 6f72 3d22 6d69 6464 6c65 2220 783d chor=\"middle\" x=\n+0000d740: 2236 3334 2e35 3622 2079 3d22 2d38 3434 \"634.56\" y=\"-844\n+0000d750: 2e32 3522 2066 6f6e 742d 6661 6d69 6c79 .25\" font-family\n+0000d760: 3d22 4672 6565 5361 6e73 2220 666f 6e74 =\"FreeSans\" font\n+0000d770: 2d73 697a 653d 2231 302e 3030 223e 6177 -size=\"10.00\">aw\n+0000d780: 683c 2f74 6578 743e 0a3c 2f61 3e0a 3c2f h</text>.</a>.</\n+0000d790: 673e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 g>.</g>.<!-- mod\n+0000d7a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0000d7b0: 6d64 7275 6e26 2334 353b 2667 743b 6d6f mdrun->mo\n+0000d7c0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000d7d0: 5f61 7070 6c69 6564 5f66 6f72 6365 735f _applied_forces_\n+0000d7e0: 6177 6820 2d2d 3e0a 3c67 2069 643d 2265 awh -->.<g id=\"e\n+0000d7f0: 6467 6536 3222 2063 6c61 7373 3d22 6564 dge62\" class=\"ed\n+0000d800: 6765 223e 0a3c 7469 746c 653e 6d6f 6475 ge\">.<title>modu\n+0000d810: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+0000d820: 6472 756e 2623 3435 3b26 6774 3b6d 6f64 drun->mod\n+0000d830: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0000d840: 6170 706c 6965 645f 666f 7263 6573 5f61 applied_forces_a\n+0000d850: 7768 3c2f 7469 746c 653e 0a3c 7061 7468 wh.....\n+0000da50: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n+0000da60: 7263 5f67 726f 6d61 6373 5f63 6f6f 7264 rc_gromacs_coord\n+0000da70: 696e 6174 6569 6f3c 2f74 6974 6c65 3e0a inateio.\n+0000da80: 3c67 2069 643d 2261 5f6e 6f64 6532 3022 ..\n+0000dba0: 636f 6f72 6469 6e61 7465 696f 3c2f 7465 coordinateio.....<\n+0000dc10: 6720 6964 3d22 6564 6765 3831 2220 636c g id=\"edge81\" cl\n+0000dc20: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.module_src_gr\n+0000dc40: 6f6d 6163 735f 636f 6f72 6469 6e61 7465 omacs_coordinate\n+0000dc50: 696f 2623 3435 3b26 6774 3b6d 6f64 756c io->modul\n+0000dc60: 655f 7372 635f 6772 6f6d 6163 735f 6f70 e_src_gromacs_op\n+0000dc70: 7469 6f6e 733c 2f74 6974 6c65 3e0a 3c70 tions...<\n+0000de60: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...\n+0000ded0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000dee0: 6373 5f69 6d64 2623 3435 3b26 6774 3b6d cs_imd->m\n+0000def0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000df00: 735f 6d64 7275 6e75 7469 6c69 7479 3c2f s_mdrunutility</\n+0000df10: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+0000df20: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+0000df30: 2223 3238 3266 6363 2220 7374 726f 6b65 \"#282fcc\" stroke\n+0000df40: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n+0000df50: 2064 3d22 4d38 3139 2e34 362c 2d31 3638 d=\"M819.46,-168\n+0000df60: 2e30 3943 3738 322e 382c 2d32 3136 2e31 .09C782.8,-216.1\n+0000df70: 3220 3634 362e 312c 2d33 3935 2e39 2036 2 646.1,-395.9 6\n+0000df80: 3037 2e35 362c 2d34 3536 2e30 3920 3537 07.56,-456.09 57\n+0000df90: 382e 3532 2c2d 3530 312e 3435 2034 3430 8.52,-501.45 440\n+0000dfa0: 2e30 392c 2d37 3532 2e35 3220 3433 352e .09,-752.52 435.\n+0000dfb0: 3536 2c2d 3737 302e 3434 2034 3235 2e30 56,-770.44 425.0\n+0000dfc0: 362c 2d38 3131 2e39 3420 3434 322e 3538 6,-811.94 442.58\n+0000dfd0: 2c2d 3832 372e 3738 2034 3730 2e35 362c ,-827.78 470.56,\n+0000dfe0: 2d38 3630 2e31 3820 3630 312e 3932 2c2d -860.18 601.92,-\n+0000dff0: 3130 3132 2e32 3920 3638 352e 3139 2c2d 1012.29 685.19,-\n+0000e000: 3130 3035 2e39 3820 3838 312e 3536 2c2d 1005.98 881.56,-\n+0000e010: 3130 3438 2e37 3920 3130 3134 2e32 362c 1048.79 1014.26,\n+0000e020: 2d31 3037 372e 3732 2031 3432 362e 3033 -1077.72 1426.03\n+0000e030: 2c2d 3130 3931 2e35 3620 3135 3737 2e37 ,-1091.56 1577.7\n+0000e040: 312c 2d31 3039 352e 3738 222f 3e0a 3c70 1,-1095.78\"/>.<p\n+0000e050: 6f6c 7967 6f6e 2066 696c 6c3d 2223 3238 olygon fill=\"#28\n+0000e060: 3266 6363 2220 7374 726f 6b65 3d22 2332 2fcc\" stroke=\"#2\n+0000e070: 3832 6663 6322 2070 6f69 6e74 733d 2231 82fcc\" points=\"1\n+0000e080: 3537 372e 3636 2c2d 3130 3939 2e32 3820 577.66,-1099.28 \n+0000e090: 3135 3837 2e37 352c 2d31 3039 362e 3035 1587.75,-1096.05\n+0000e0a0: 2031 3537 372e 3835 2c2d 3130 3932 2e32 1577.85,-1092.2\n+0000e0b0: 3820 3135 3737 2e36 362c 2d31 3039 392e 8 1577.66,-1099.\n+0000e0c0: 3238 222f 3e0a 3c2f 673e 0a3c 212d 2d20 28\"/>.</g>.<!-- \n+0000e0d0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000e0e0: 6373 5f69 6d64 2623 3435 3b26 6774 3b6d cs_imd->m\n+0000e0f0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000e100: 735f 676d 786c 6962 202d 2d3e 0a3c 6720 s_gmxlib -->.<g \n+0000e110: 6964 3d22 6564 6765 3835 2220 636c 6173 id=\"edge85\" clas\n+0000e120: 733d 2265 6467 6522 3e0a 3c74 6974 6c65 s=\"edge\">.<title\n+0000e130: 3e6d 6f64 756c 655f 7372 635f 6772 6f6d >module_src_grom\n+0000e140: 6163 735f 696d 6426 2334 353b 2667 743b acs_imd->\n+0000e150: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000e160: 6373 5f67 6d78 6c69 623c 2f74 6974 6c65 cs_gmxlib</title\n+0000e170: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+0000e180: 6e65 2220 7374 726f 6b65 3d22 2362 6662 ne\" stroke=\"#bfb\n+0000e190: 6662 6622 2064 3d22 4d38 3335 2e37 322c fbf\" d=\"M835.72,\n+0000e1a0: 2d31 3638 2e35 3543 3837 332e 3332 2c2d -168.55C873.32,-\n+0000e1b0: 3233 322e 3338 2031 3035 352e 3031 2c2d 232.38 1055.01,-\n+0000e1c0: 3532 372e 3133 2031 3238 352e 3536 2c2d 527.13 1285.56,-\n+0000e1d0: 3637 312e 3537 2031 3333 352e 3238 2c2d 671.57 1335.28,-\n+0000e1e0: 3730 322e 3732 2031 3336 362e 3534 2c2d 702.72 1366.54,-\n+0000e1f0: 3637 312e 3139 2031 3431 322e 3536 2c2d 671.19 1412.56,-\n+0000e200: 3730 372e 3537 2031 3432 332e 3239 2c2d 707.57 1423.29,-\n+0000e210: 3731 362e 3035 2031 3431 362e 3231 2c2d 716.05 1416.21,-\n+0000e220: 3732 362e 3831 2031 3432 372e 3536 2c2d 726.81 1427.56,-\n+0000e230: 3733 342e 3434 2031 3438 342e 3231 2c2d 734.44 1484.21,-\n+0000e240: 3737 322e 3535 2031 3638 392e 3536 2c2d 772.55 1689.56,-\n+0000e250: 3738 302e 3638 2031 3737 382e 3734 2c2d 780.68 1778.74,-\n+0000e260: 3738 322e 3431 222f 3e0a 3c70 6f6c 7967 782.41\"/>.<polyg\n+0000e270: 6f6e 2066 696c 6c3d 2223 6266 6266 6266 on fill=\"#bfbfbf\n+0000e280: 2220 7374 726f 6b65 3d22 2362 6662 6662 \" stroke=\"#bfbfb\n+0000e290: 6622 2070 6f69 6e74 733d 2231 3737 382e f\" points=\"1778.\n+0000e2a0: 3731 2c2d 3738 352e 3931 2031 3738 382e 71,-785.91 1788.\n+0000e2b0: 3737 2c2d 3738 322e 3539 2031 3737 382e 77,-782.59 1778.\n+0000e2c0: 3833 2c2d 3737 382e 3931 2031 3737 382e 83,-778.91 1778.\n+0000e2d0: 3731 2c2d 3738 352e 3931 222f 3e0a 3c2f 71,-785.91\"/>.</\n+0000e2e0: 673e 0a3c 212d 2d20 6d6f 6475 6c65 5f73 g>.<!-- module_s\n+0000e2f0: 7263 5f67 726f 6d61 6373 5f69 6d64 2623 rc_gromacs_imd&#\n+0000e300: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+0000e310: 635f 6772 6f6d 6163 735f 6d64 7479 7065 c_gromacs_mdtype\n+0000e320: 7320 2d2d 3e0a 3c67 2069 643d 2265 6467 s -->.<g id=\"edg\n+0000e330: 6538 3822 2063 6c61 7373 3d22 6564 6765 e88\" class=\"edge\n+0000e340: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n+0000e350: 5f73 7263 5f67 726f 6d61 6373 5f69 6d64 _src_gromacs_imd\n+0000e360: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+0000e370: 7372 635f 6772 6f6d 6163 735f 6d64 7479 src_gromacs_mdty\n+0000e380: 7065 733c 2f74 6974 6c65 3e0a 3c70 6174 pes......\n+0000e580: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000e590: 6373 5f69 6d64 2623 3435 3b26 6774 3b6d cs_imd->m\n+0000e5a0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000e5b0: 735f 6d64 6c69 623c 2f74 6974 6c65 3e0a s_mdlib.\n+0000e5c0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ..\n+0000e6d0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 .\n+0000e8f0: 0a3c 6720 6964 3d22 6564 6765 3833 2220 ..module_src_\n+0000e920: 6772 6f6d 6163 735f 696d 6426 2334 353b gromacs_imd-\n+0000e930: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+0000e940: 726f 6d61 6373 5f64 6f6d 6465 633c 2f74 romacs_domdec.....\n+0000eb40: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n+0000eb50: 7263 5f67 726f 6d61 6373 5f69 6d64 2623 rc_gromacs_imd&#\n+0000eb60: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+0000eb70: 635f 6772 6f6d 6163 735f 636f 6d6d 616e c_gromacs_comman\n+0000eb80: 646c 696e 653c 2f74 6974 6c65 3e0a 3c70 dline.\n+0000ec90: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .\n+0000ed00: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....mo\n+0000ed50: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000ed60: 5f70 6263 7574 696c 3c2f 7469 746c 653e _pbcutil\n+0000ed70: 0a3c 656c 6c69 7073 6520 6669 6c6c 3d22 ..pbcutil<\n+0000ee30: 2f74 6578 743e 0a3c 2f67 3e0a 3c21 2d2d /text>....module_\n+0000eeb0: 7372 635f 6772 6f6d 6163 735f 7062 6375 src_gromacs_pbcu\n+0000eec0: 7469 6c26 2334 353b 2667 743b 6d6f 6475 til->modu\n+0000eed0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+0000eee0: 7075 5f75 7469 6c73 3c2f 7469 746c 653e pu_utils\n+0000eef0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ...\n+0000efd0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ..\n+0000f000: 3c67 2069 643d 226e 6f64 6532 3322 2063 .module_src_g\n+0000f030: 726f 6d61 6373 5f74 7261 6a65 6374 6f72 romacs_trajector\n+0000f040: 7961 6e61 6c79 7369 733c 2f74 6974 6c65 yanalysis...\n+0000f180: 7472 616a 6563 746f 7279 616e 616c 7973 trajectoryanalys\n+0000f190: 6973 3c2f 7465 7874 3e0a 3c2f 613e 0a3c is..<\n+0000f1a0: 2f67 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f /g>....mo\n+0000f220: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000f230: 5f74 7261 6a65 6374 6f72 7961 6e61 6c79 _trajectoryanaly\n+0000f240: 7369 7326 2334 353b 2667 743b 6d6f 6475 sis->modu\n+0000f250: 6c65 5f73 7263 5f67 726f 6d61 6373 5f72 le_src_gromacs_r\n+0000f260: 616e 646f 6d3c 2f74 6974 6c65 3e0a 3c70 andom.....\n+0000f420: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n+0000f430: 7263 5f67 726f 6d61 6373 5f74 7261 6a65 rc_gromacs_traje\n+0000f440: 6374 6f72 7961 6e61 6c79 7369 7326 2334 ctoryanalysis\n+0000f450: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+0000f460: 5f67 726f 6d61 6373 5f61 6e61 6c79 7369 _gromacs_analysi\n+0000f470: 7364 6174 613c 2f74 6974 6c65 3e0a 3c70 sdata...<\n+0000f570: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...m\n+0000f5f0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000f600: 735f 7472 616a 6563 746f 7279 616e 616c s_trajectoryanal\n+0000f610: 7973 6973 2623 3435 3b26 6774 3b6d 6f64 ysis->mod\n+0000f620: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0000f630: 636f 6f72 6469 6e61 7465 696f 3c2f 7469 coordinateio</ti\n+0000f640: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n+0000f650: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n+0000f660: 3238 3266 6363 2220 7374 726f 6b65 2d64 282fcc\" stroke-d\n+0000f670: 6173 6861 7272 6179 3d22 352c 3222 2064 asharray=\"5,2\" d\n+0000f680: 3d22 4d31 3030 332e 3935 2c2d 3737 312e =\"M1003.95,-771.\n+0000f690: 3731 4339 3738 2e32 322c 2d37 3631 2e36 71C978.22,-761.6\n+0000f6a0: 3720 3934 302e 3331 2c2d 3734 362e 3838 7 940.31,-746.88\n+0000f6b0: 2039 3132 2e35 332c 2d37 3336 2e30 3422 912.53,-736.04\"\n+0000f6c0: 2f3e 0a3c 706f 6c79 676f 6e20 6669 6c6c />.<polygon fill\n+0000f6d0: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+0000f6e0: 653d 2223 3238 3266 6363 2220 706f 696e e=\"#282fcc\" poin\n+0000f6f0: 7473 3d22 3931 332e 3736 2c2d 3733 322e ts=\"913.76,-732.\n+0000f700: 3736 2039 3033 2e31 372c 2d37 3332 2e33 76 903.17,-732.3\n+0000f710: 3920 3931 312e 3231 2c2d 3733 392e 3238 9 911.21,-739.28\n+0000f720: 2039 3133 2e37 362c 2d37 3332 2e37 3622 913.76,-732.76\"\n+0000f730: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />.</g>.<!-- mod\n+0000f740: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0000f750: 676d 7861 6e61 202d 2d3e 0a3c 6720 6964 gmxana -->.<g id\n+0000f760: 3d22 6e6f 6465 3234 2220 636c 6173 733d =\"node24\" class=\n+0000f770: 226e 6f64 6522 3e0a 3c74 6974 6c65 3e6d \"node\">.<title>m\n+0000f780: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000f790: 735f 676d 7861 6e61 3c2f 7469 746c 653e s_gmxana\n+0000f7a0: 0a3c 656c 6c69 7073 6520 6669 6c6c 3d22 ..gmxana....modu\n+0000f8e0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f74 le_src_gromacs_t\n+0000f8f0: 7261 6a65 6374 6f72 7961 6e61 6c79 7369 rajectoryanalysi\n+0000f900: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n+0000f910: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n+0000f920: 616e 613c 2f74 6974 6c65 3e0a 3c70 6174 ana......modu\n+0000fa70: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+0000fa80: 6d78 7072 6570 726f 6365 7373 3c2f 7469 mxpreprocess</ti\n+0000fa90: 746c 653e 0a3c 656c 6c69 7073 6520 6669 tle>.<ellipse fi\n+0000faa0: 6c6c 3d22 2362 6662 6662 6622 2073 7472 ll=\"#bfbfbf\" str\n+0000fab0: 6f6b 653d 2262 6c61 636b 2220 6378 3d22 oke=\"black\" cx=\"\n+0000fac0: 3130 3538 2e35 3622 2063 793d 222d 3131 1058.56\" cy=\"-11\n+0000fad0: 3631 2e31 2220 7278 3d22 3538 2e38 3822 61.1\" rx=\"58.88\"\n+0000fae0: 2072 793d 2231 332e 3337 222f 3e0a 3c74 ry=\"13.37\"/>.<t\n+0000faf0: 6578 7420 7465 7874 2d61 6e63 686f 723d ext text-anchor=\n+0000fb00: 226d 6964 646c 6522 2078 3d22 3130 3538 \"middle\" x=\"1058\n+0000fb10: 2e35 3622 2079 3d22 2d31 3135 382e 3622 .56\" y=\"-1158.6\"\n+0000fb20: 2066 6f6e 742d 6661 6d69 6c79 3d22 4672 font-family=\"Fr\n+0000fb30: 6565 5361 6e73 2220 666f 6e74 2d73 697a eeSans\" font-siz\n+0000fb40: 653d 2231 302e 3030 223e 676d 7870 7265 e=\"10.00\">gmxpre\n+0000fb50: 7072 6f63 6573 733c 2f74 6578 743e 0a3c process</text>.<\n+0000fb60: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.<!-- module_\n+0000fb70: 7372 635f 6772 6f6d 6163 735f 7472 616a src_gromacs_traj\n+0000fb80: 6563 746f 7279 616e 616c 7973 6973 2623 ectoryanalysis&#\n+0000fb90: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+0000fba0: 635f 6772 6f6d 6163 735f 676d 7870 7265 c_gromacs_gmxpre\n+0000fbb0: 7072 6f63 6573 7320 2d2d 3e0a 3c67 2069 process -->.<g i\n+0000fbc0: 643d 2265 6467 6539 3622 2063 6c61 7373 d=\"edge96\" class\n+0000fbd0: 3d22 6564 6765 223e 0a3c 7469 746c 653e =\"edge\">.<title>\n+0000fbe0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0000fbf0: 6373 5f74 7261 6a65 6374 6f72 7961 6e61 cs_trajectoryana\n+0000fc00: 6c79 7369 7326 2334 353b 2667 743b 6d6f lysis->mo\n+0000fc10: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0000fc20: 5f67 6d78 7072 6570 726f 6365 7373 3c2f _gmxpreprocess</\n+0000fc30: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+0000fc40: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+0000fc50: 2223 3263 6363 3238 2220 7374 726f 6b65 \"#2ccc28\" stroke\n+0000fc60: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n+0000fc70: 2064 3d22 4d39 3834 2e34 362c 2d37 3933 d=\"M984.46,-793\n+0000fc80: 2e30 3943 3835 352e 3739 2c2d 3831 372e .09C855.79,-817.\n+0000fc90: 3239 2035 3139 2e36 322c 2d38 3936 2e33 29 519.62,-896.3\n+0000fca0: 3920 3631 332e 3536 2c2d 3130 3438 2e37 9 613.56,-1048.7\n+0000fcb0: 3920 3635 332e 3432 2c2d 3131 3133 2e34 9 653.42,-1113.4\n+0000fcc0: 3620 3838 312e 3034 2c2d 3131 3433 2e35 6 881.04,-1143.5\n+0000fcd0: 3620 3939 342e 3431 2c2d 3131 3534 2e37 6 994.41,-1154.7\n+0000fce0: 222f 3e0a 3c70 6f6c 7967 6f6e 2066 696c \"/>.<polygon fil\n+0000fcf0: 6c3d 2223 3263 6363 3238 2220 7374 726f l=\"#2ccc28\" stro\n+0000fd00: 6b65 3d22 2332 6363 6332 3822 2070 6f69 ke=\"#2ccc28\" poi\n+0000fd10: 6e74 733d 2239 3934 2e34 2c2d 3131 3538 nts=\"994.4,-1158\n+0000fd20: 2e32 3120 3130 3034 2e36 392c 2d31 3135 .21 1004.69,-115\n+0000fd30: 352e 3639 2039 3935 2e30 372c 2d31 3135 5.69 995.07,-115\n+0000fd40: 312e 3235 2039 3934 2e34 2c2d 3131 3538 1.25 994.4,-1158\n+0000fd50: 2e32 3122 2f3e 0a3c 2f67 3e0a 3c21 2d2d .21\"/>.</g>.<!--\n+0000fd60: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n+0000fd70: 6163 735f 7374 6174 6973 7469 6373 202d acs_statistics -\n+0000fd80: 2d3e 0a3c 6720 6964 3d22 6e6f 6465 3330 ->.<g id=\"node30\n+0000fd90: 2220 636c 6173 733d 226e 6f64 6522 3e0a \" class=\"node\">.\n+0000fda0: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 <title>module_sr\n+0000fdb0: 635f 6772 6f6d 6163 735f 7374 6174 6973 c_gromacs_statis\n+0000fdc0: 7469 6373 3c2f 7469 746c 653e 0a3c 656c tics..statistics....module_src_grom\n+0000ff20: 6163 735f 7472 616a 6563 746f 7279 616e acs_trajectoryan\n+0000ff30: 616c 7973 6973 2623 3435 3b26 6774 3b6d alysis->m\n+0000ff40: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0000ff50: 735f 7374 6174 6973 7469 6373 3c2f 7469 s_statistics.....<\n+000100b0: 6720 6964 3d22 6564 6765 3932 2220 636c g id=\"edge92\" cl\n+000100c0: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.module_src_gr\n+000100e0: 6f6d 6163 735f 7472 616a 6563 746f 7279 omacs_trajectory\n+000100f0: 616e 616c 7973 6973 2623 3435 3b26 6774 analysis->\n+00010100: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+00010110: 6163 735f 6669 6c65 696f 3c2f 7469 746c acs_fileio..<\n+000101e0: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n+000101f0: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n+00010200: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n+00010210: 3130 3037 2e31 382c 2d36 3732 2e31 3220 1007.18,-672.12 \n+00010220: 3130 3135 2e33 362c 2d36 3635 2e33 3920 1015.36,-665.39 \n+00010230: 3130 3034 2e37 362c 2d36 3635 2e35 3520 1004.76,-665.55 \n+00010240: 3130 3037 2e31 382c 2d36 3732 2e31 3222 1007.18,-672.12\"\n+00010250: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />....module_src_gro\n+000102e0: 6d61 6373 5f74 7261 6a65 6374 6f72 7961 macs_trajectorya\n+000102f0: 6e61 6c79 7369 7326 2334 353b 2667 743b nalysis->\n+00010300: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00010310: 6373 5f63 6f6d 6d61 6e64 6c69 6e65 3c2f cs_commandline...\n+00010420: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...modul\n+00010490: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n+000104a0: 7861 6e61 2623 3435 3b26 6774 3b6d 6f64 xana->mod\n+000104b0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000104c0: 7261 6e64 6f6d 3c2f 7469 746c 653e 0a3c random.<\n+000104d0: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n+000104e0: 2073 7472 6f6b 653d 2262 6c61 636b 2220 stroke=\"black\" \n+000104f0: 7374 726f 6b65 2d64 6173 6861 7272 6179 stroke-dasharray\n+00010500: 3d22 352c 3222 2064 3d22 4d38 3437 2e36 =\"5,2\" d=\"M847.6\n+00010510: 322c 2d39 3730 2e33 3943 3736 302e 3335 2,-970.39C760.35\n+00010520: 2c2d 3936 352e 3532 2035 3333 2e33 392c ,-965.52 533.39,\n+00010530: 2d39 3339 2e31 3420 3434 332e 3536 2c2d -939.14 443.56,-\n+00010540: 3739 372e 3331 2034 3337 2e31 372c 2d37 797.31 437.17,-7\n+00010550: 3837 2e32 3220 3434 322e 3234 2c2d 3738 87.22 442.24,-78\n+00010560: 322e 3331 2034 3433 2e35 362c 2d37 3730 2.31 443.56,-770\n+00010570: 2e34 3420 3434 392e 3135 2c2d 3732 302e .44 449.15,-720.\n+00010580: 3035 2034 3638 2e35 362c 2d37 3039 2e38 05 468.56,-709.8\n+00010590: 3420 3436 382e 3536 2c2d 3635 392e 3134 4 468.56,-659.14\n+000105a0: 2034 3638 2e35 362c 2d36 3539 2e31 3420 468.56,-659.14 \n+000105b0: 3436 382e 3536 2c2d 3635 392e 3134 2034 468.56,-659.14 4\n+000105c0: 3638 2e35 362c 2d34 3638 2e35 3320 3436 68.56,-468.53 46\n+000105d0: 382e 3536 2c2d 3334 392e 3839 2034 3736 8.56,-349.89 476\n+000105e0: 2e38 2c2d 3331 382e 3932 2035 3038 2e35 .8,-318.92 508.5\n+000105f0: 362c 2d32 3034 2e36 3120 3531 312e 3035 6,-204.61 511.05\n+00010600: 2c2d 3139 352e 3634 2035 3134 2e37 352c ,-195.64 514.75,\n+00010610: 2d31 3836 2e30 3920 3531 382e 3239 2c2d -186.09 518.29,-\n+00010620: 3137 372e 3837 222f 3e0a 3c70 6f6c 7967 177.87\"/>....\n+000106e0: 3c67 2069 643d 2265 6467 6531 3033 2220 .module_src_\n+00010710: 6772 6f6d 6163 735f 676d 7861 6e61 2623 gromacs_gmxana&#\n+00010720: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+00010730: 635f 6772 6f6d 6163 735f 6d64 7370 616e c_gromacs_mdspan\n+00010740: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ....\n+00010990: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module_src_grom\n+00010a10: 6163 735f 676d 7861 6e61 2623 3435 3b26 acs_gmxana-&\n+00010a20: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00010a30: 6f6d 6163 735f 6c69 7374 6564 5f66 6f72 omacs_listed_for\n+00010a40: 6365 733c 2f74 6974 6c65 3e0a 3c70 6174 ces......module\n+00010ce0: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n+00010cf0: 616e 6126 2334 353b 2667 743b 6d6f 6475 ana->modu\n+00010d00: 6c65 5f73 7263 5f67 726f 6d61 6373 5f63 le_src_gromacs_c\n+00010d10: 6f72 7265 6c61 7469 6f6e 6675 6e63 7469 orrelationfuncti\n+00010d20: 6f6e 733c 2f74 6974 6c65 3e0a 3c70 6174 ons......module_src_grom\n+00010ec0: 6163 735f 676d 7861 6e61 2623 3435 3b26 acs_gmxana-&\n+00010ed0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00010ee0: 6f6d 6163 735f 6666 743c 2f74 6974 6c65 omacs_fft..\n+00011030: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....\n+000110a0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+000110b0: 6373 5f67 6d78 616e 6126 2334 353b 2667 cs_gmxana-&g\n+000110c0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+000110d0: 6d61 6373 5f67 6d78 6c69 623c 2f74 6974 macs_gmxlib</tit\n+000110e0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n+000110f0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2362 none\" stroke=\"#b\n+00011100: 6662 6662 6622 2064 3d22 4d39 3136 2e39 fbfbf\" d=\"M916.9\n+00011110: 2c2d 3936 392e 3036 4339 3837 2e37 382c ,-969.06C987.78,\n+00011120: 2d39 3633 2e37 3120 3131 3535 2e31 392c -963.71 1155.19,\n+00011130: 2d39 3439 2e32 3120 3132 3933 2e35 362c -949.21 1293.56,\n+00011140: 2d39 3233 2e30 3520 3134 3832 2e32 362c -923.05 1482.26,\n+00011150: 2d38 3837 2e33 3720 3137 3033 2e31 332c -887.37 1703.13,\n+00011160: 2d38 3231 2e33 3820 3137 3836 2e34 352c -821.38 1786.45,\n+00011170: 2d37 3935 2e35 3922 2f3e 0a3c 706f 6c79 -795.59\"/>.<poly\n+00011180: 676f 6e20 6669 6c6c 3d22 2362 6662 6662 gon fill=\"#bfbfb\n+00011190: 6622 2073 7472 6f6b 653d 2223 6266 6266 f\" stroke=\"#bfbf\n+000111a0: 6266 2220 706f 696e 7473 3d22 3137 3837 bf\" points=\"1787\n+000111b0: 2e36 332c 2d37 3938 2e38 3920 3137 3936 .63,-798.89 1796\n+000111c0: 2e31 342c 2d37 3932 2e35 3820 3137 3835 .14,-792.58 1785\n+000111d0: 2e35 352c 2d37 3932 2e32 2031 3738 372e .55,-792.2 1787.\n+000111e0: 3633 2c2d 3739 382e 3839 222f 3e0a 3c2f 63,-798.89\"/>.</\n+000111f0: 673e 0a3c 212d 2d20 6d6f 6475 6c65 5f73 g>.<!-- module_s\n+00011200: 7263 5f67 726f 6d61 6373 5f67 6d78 616e rc_gromacs_gmxan\n+00011210: 6126 2334 353b 2667 743b 6d6f 6475 6c65 a->module\n+00011220: 5f73 7263 5f67 726f 6d61 6373 5f6d 6474 _src_gromacs_mdt\n+00011230: 7970 6573 202d 2d3e 0a3c 6720 6964 3d22 ypes -->.<g id=\"\n+00011240: 6564 6765 3130 3622 2063 6c61 7373 3d22 edge106\" class=\"\n+00011250: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n+00011260: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00011270: 5f67 6d78 616e 6126 2334 353b 2667 743b _gmxana->\n+00011280: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00011290: 6373 5f6d 6474 7970 6573 3c2f 7469 746c cs_mdtypes</titl\n+000112a0: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n+000112b0: 6f6e 6522 2073 7472 6f6b 653d 2223 6266 one\" stroke=\"#bf\n+000112c0: 6266 6266 2220 643d 224d 3931 372e 3439 bfbf\" d=\"M917.49\n+000112d0: 2c2d 3936 392e 3837 4331 3033 362e 3332 ,-969.87C1036.32\n+000112e0: 2c2d 3936 342e 3320 3134 3335 2e38 322c ,-964.3 1435.82,\n+000112f0: 2d39 3435 2e30 3720 3137 3635 2e35 362c -945.07 1765.56,\n+00011300: 2d39 3233 2e30 3520 3138 3033 2e30 352c -923.05 1803.05,\n+00011310: 2d39 3230 2e35 3520 3138 3435 2e35 312c -920.55 1845.51,\n+00011320: 2d39 3137 2e31 3820 3138 3736 2e39 362c -917.18 1876.96,\n+00011330: 2d39 3134 2e35 3822 2f3e 0a3c 706f 6c79 -914.58\"/>.<poly\n+00011340: 676f 6e20 6669 6c6c 3d22 2362 6662 6662 gon fill=\"#bfbfb\n+00011350: 6622 2073 7472 6f6b 653d 2223 6266 6266 f\" stroke=\"#bfbf\n+00011360: 6266 2220 706f 696e 7473 3d22 3138 3737 bf\" points=\"1877\n+00011370: 2e35 2c2d 3931 382e 3034 2031 3838 372e .5,-918.04 1887.\n+00011380: 3138 2c2d 3931 332e 3733 2031 3837 362e 18,-913.73 1876.\n+00011390: 3932 2c2d 3931 312e 3037 2031 3837 372e 92,-911.07 1877.\n+000113a0: 352c 2d39 3138 2e30 3422 2f3e 0a3c 2f67 5,-918.04\"/>.</g\n+000113b0: 3e0a 3c21 2d2d 206d 6f64 756c 655f 7372 >.<!-- module_sr\n+000113c0: 635f 6772 6f6d 6163 735f 676d 7861 6e61 c_gromacs_gmxana\n+000113d0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+000113e0: 7372 635f 6772 6f6d 6163 735f 7374 6174 src_gromacs_stat\n+000113f0: 6973 7469 6373 202d 2d3e 0a3c 6720 6964 istics -->.<g id\n+00011400: 3d22 6564 6765 3130 3822 2063 6c61 7373 =\"edge108\" class\n+00011410: 3d22 6564 6765 223e 0a3c 7469 746c 653e =\"edge\">.<title>\n+00011420: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00011430: 6373 5f67 6d78 616e 6126 2334 353b 2667 cs_gmxana-&g\n+00011440: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00011450: 6d61 6373 5f73 7461 7469 7374 6963 733c macs_statistics<\n+00011460: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+00011470: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+00011480: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+00011490: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n+000114a0: 2220 643d 224d 3930 332e 3631 2c2d 3936 \" d=\"M903.61,-96\n+000114b0: 312e 3636 4339 3438 2e38 2c2d 3933 392e 1.66C948.8,-939.\n+000114c0: 3420 3130 3535 2e31 382c 2d38 3830 2e35 4 1055.18,-880.5\n+000114d0: 3120 3131 3036 2e35 362c 2d37 3937 2e33 1 1106.56,-797.3\n+000114e0: 3120 3131 3136 2e32 352c 2d37 3831 2e36 1 1116.25,-781.6\n+000114f0: 3120 3131 3139 2e38 352c 2d37 3630 2e38 1 1119.85,-760.8\n+00011500: 3820 3131 3231 2e31 312c 2d37 3435 2e31 8 1121.11,-745.1\n+00011510: 3422 2f3e 0a3c 706f 6c79 676f 6e20 6669 4\"/>.<polygon fi\n+00011520: 6c6c 3d22 2332 3832 6663 6322 2073 7472 ll=\"#282fcc\" str\n+00011530: 6f6b 653d 2223 3238 3266 6363 2220 706f oke=\"#282fcc\" po\n+00011540: 696e 7473 3d22 3131 3234 2e36 332c 2d37 ints=\"1124.63,-7\n+00011550: 3434 2e38 3820 3131 3231 2e36 372c 2d37 44.88 1121.67,-7\n+00011560: 3334 2e37 3120 3131 3137 2e36 342c 2d37 34.71 1117.64,-7\n+00011570: 3434 2e35 3120 3131 3234 2e36 332c 2d37 44.51 1124.63,-7\n+00011580: 3434 2e38 3822 2f3e 0a3c 2f67 3e0a 3c21 44.88\"/>.</g>.<!\n+00011590: 2d2d 206d 6f64 756c 655f 7372 635f 6772 -- module_src_gr\n+000115a0: 6f6d 6163 735f 676d 7861 6e61 2623 3435 omacs_gmxana-\n+000115b0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+000115c0: 6772 6f6d 6163 735f 6d64 6c69 6220 2d2d gromacs_mdlib --\n+000115d0: 3e0a 3c67 2069 643d 2265 6467 6531 3031 >.<g id=\"edge101\n+000115e0: 2220 636c 6173 733d 2265 6467 6522 3e0a \" class=\"edge\">.\n+000115f0: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 <title>module_sr\n+00011600: 635f 6772 6f6d 6163 735f 676d 7861 6e61 c_gromacs_gmxana\n+00011610: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+00011620: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n+00011630: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b..\n+00011830: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_src_grom\n+00011920: 6163 735f 676d 7861 6e61 2623 3435 3b26 acs_gmxana-&\n+00011930: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00011940: 6f6d 6163 735f 6669 6c65 696f 3c2f 7469 omacs_fileio.....\n+00011b20: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n+00011b30: 7263 5f67 726f 6d61 6373 5f67 6d78 616e rc_gromacs_gmxan\n+00011b40: 6126 2334 353b 2667 743b 6d6f 6475 6c65 a->module\n+00011b50: 5f73 7263 5f67 726f 6d61 6373 5f63 6f6d _src_gromacs_com\n+00011b60: 6d61 6e64 6c69 6e65 3c2f 7469 746c 653e mandline\n+00011b70: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....<\n+00011c90: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+00011ca0: 726f 6d61 6373 5f74 7261 6a65 6374 6f72 romacs_trajector\n+00011cb0: 7920 2d2d 3e0a 3c67 2069 643d 226e 6f64 y -->..module\n+00011ce0: 5f73 7263 5f67 726f 6d61 6373 5f74 7261 _src_gromacs_tra\n+00011cf0: 6a65 6374 6f72 793c 2f74 6974 6c65 3e0a jectory.\n+00011d00: 3c65 6c6c 6970 7365 2066 696c 6c3d 2223 .trajectory....\n+000120b0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+000120c0: 6373 5f67 6d78 616e 6126 2334 353b 2667 cs_gmxana-&g\n+000120d0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+000120e0: 6d61 6373 5f61 7070 6c69 6564 5f66 6f72 macs_applied_for\n+000120f0: 6365 735f 6177 683c 2f74 6974 6c65 3e0a ces_awh.\n+00012100: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ....\n+00012290: 3c67 2069 643d 2265 6467 6531 3135 2220 .module_src_\n+000122c0: 6772 6f6d 6163 735f 676d 786c 6962 2623 gromacs_gmxlib&#\n+000122d0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+000122e0: 635f 6772 6f6d 6163 735f 7461 626c 6573 c_gromacs_tables\n+000122f0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......module_\n+00012570: 7372 635f 6772 6f6d 6163 735f 676d 786c src_gromacs_gmxl\n+00012580: 6962 2623 3435 3b26 6774 3b6d 6f64 756c ib->modul\n+00012590: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n+000125a0: 7479 7065 733c 2f74 6974 6c65 3e0a 3c70 types......\n+00012720: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 module_sr\n+00012730: 635f 6772 6f6d 6163 735f 676d 786c 6962 c_gromacs_gmxlib\n+00012740: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+00012750: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n+00012760: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b......module_src_grom\n+00012940: 6163 735f 676d 786c 6962 2623 3435 3b26 acs_gmxlib-&\n+00012950: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00012960: 6f6d 6163 735f 636f 6d6d 616e 646c 696e omacs_commandlin\n+00012970: 653c 2f74 6974 6c65 3e0a 3c70 6174 6820 e......module_src_gr\n+00012b10: 6f6d 6163 735f 676d 786c 6962 2623 3435 omacs_gmxlib-\n+00012b20: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00012b30: 6772 6f6d 6163 735f 6577 616c 643c 2f74 gromacs_ewald......module_src_gr\n+00012f50: 6f6d 6163 735f 7365 6c65 6374 696f 6e26 omacs_selection&\n+00012f60: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00012f70: 7263 5f67 726f 6d61 6373 5f72 616e 646f rc_gromacs_rando\n+00012f80: 6d3c 2f74 6974 6c65 3e0a 3c70 6174 6820 m......module_\n+00013180: 7372 635f 6772 6f6d 6163 735f 7365 6c65 src_gromacs_sele\n+00013190: 6374 696f 6e26 2334 353b 2667 743b 6d6f ction->mo\n+000131a0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000131b0: 5f6f 6e6c 696e 6568 656c 703c 2f74 6974 _onlinehelp</tit\n+000131c0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n+000131d0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n+000131e0: 3832 6663 6322 2064 3d22 4d31 3633 302e 82fcc\" d=\"M1630.\n+000131f0: 3837 2c2d 3730 372e 3639 4331 3633 362e 87,-707.69C1636.\n+00013200: 3938 2c2d 3639 392e 3620 3136 3435 2e31 98,-699.6 1645.1\n+00013210: 322c 2d36 3838 2e38 3320 3136 3532 2e31 2,-688.83 1652.1\n+00013220: 372c 2d36 3739 2e34 3922 2f3e 0a3c 706f 7,-679.49\"/>.<po\n+00013230: 6c79 676f 6e20 6669 6c6c 3d22 2332 3832 lygon fill=\"#282\n+00013240: 6663 6322 2073 7472 6f6b 653d 2223 3238 fcc\" stroke=\"#28\n+00013250: 3266 6363 2220 706f 696e 7473 3d22 3136 2fcc\" points=\"16\n+00013260: 3535 2e30 332c 2d36 3831 2e35 3220 3136 55.03,-681.52 16\n+00013270: 3538 2e32 362c 2d36 3731 2e34 3420 3136 58.26,-671.44 16\n+00013280: 3439 2e34 342c 2d36 3737 2e33 2031 3635 49.44,-677.3 165\n+00013290: 352e 3033 2c2d 3638 312e 3532 222f 3e0a 5.03,-681.52\"/>.\n+000132a0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 </g>.<!-- module\n+000132b0: 5f73 7263 5f67 726f 6d61 6373 5f73 656c _src_gromacs_sel\n+000132c0: 6563 7469 6f6e 2623 3435 3b26 6774 3b6d ection->m\n+000132d0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+000132e0: 735f 6f70 7469 6f6e 7320 2d2d 3e0a 3c67 s_options -->.<g\n+000132f0: 2069 643d 2265 6467 6531 3136 2220 636c id=\"edge116\" cl\n+00013300: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.<tit\n+00013310: 6c65 3e6d 6f64 756c 655f 7372 635f 6772 le>module_src_gr\n+00013320: 6f6d 6163 735f 7365 6c65 6374 696f 6e26 omacs_selection&\n+00013330: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00013340: 7263 5f67 726f 6d61 6373 5f6f 7074 696f rc_gromacs_optio\n+00013350: 6e73 3c2f 7469 746c 653e 0a3c 7061 7468 ns......module_src_grom\n+00013500: 6163 735f 6d64 7479 7065 7326 2334 353b acs_mdtypes-\n+00013510: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+00013520: 726f 6d61 6373 5f67 7075 5f75 7469 6c73 romacs_gpu_utils\n+00013530: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 .....<\n+00013660: 6720 6964 3d22 6564 6765 3132 3122 2063 g id=\"edge121\" c\n+00013670: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+00013690: 726f 6d61 6373 5f6d 6474 7970 6573 2623 romacs_mdtypes&#\n+000136a0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+000136b0: 635f 6772 6f6d 6163 735f 6d64 6c69 623c c_gromacs_mdlib<\n+000136c0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>..<\n+00013850: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n+00013860: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n+00013870: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n+00013880: 3135 3732 2e37 322c 2d32 3137 2e36 3120 1572.72,-217.61 \n+00013890: 3135 3632 2e34 392c 2d32 3230 2e33 3520 1562.49,-220.35 \n+000138a0: 3135 3732 2e32 2c2d 3232 342e 3539 2031 1572.2,-224.59 1\n+000138b0: 3537 322e 3732 2c2d 3231 372e 3631 222f 572.72,-217.61\"/\n+000138c0: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >....module_src_gro\n+00013940: 6d61 6373 5f6d 6474 7970 6573 2623 3435 macs_mdtypes-\n+00013950: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00013960: 6772 6f6d 6163 735f 6669 6c65 696f 3c2f gromacs_fileio......m\n+00013da0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00013db0: 735f 6d64 7479 7065 7326 2334 353b 2667 s_mdtypes-&g\n+00013dc0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00013dd0: 6d61 6373 5f65 7761 6c64 3c2f 7469 746c macs_ewald</titl\n+00013de0: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n+00013df0: 6f6e 6522 2073 7472 6f6b 653d 2223 3238 one\" stroke=\"#28\n+00013e00: 3266 6363 2220 7374 726f 6b65 2d64 6173 2fcc\" stroke-das\n+00013e10: 6861 7272 6179 3d22 352c 3222 2064 3d22 harray=\"5,2\" d=\"\n+00013e20: 4d31 3932 352e 3631 2c2d 3839 362e 3134 M1925.61,-896.14\n+00013e30: 4331 3933 302e 3739 2c2d 3838 362e 3734 C1930.79,-886.74\n+00013e40: 2031 3933 392e 3436 2c2d 3837 332e 3237 1939.46,-873.27\n+00013e50: 2031 3934 342e 3536 2c2d 3836 302e 3138 1944.56,-860.18\n+00013e60: 2031 3936 392e 3239 2c2d 3739 362e 3732 1969.29,-796.72\n+00013e70: 2031 3937 392e 3231 2c2d 3737 322e 3438 1979.21,-772.48\n+00013e80: 2031 3935 382e 3536 2c2d 3730 372e 3537 1958.56,-707.57\n+00013e90: 2031 3933 372e 3831 2c2d 3634 322e 3333 1937.81,-642.33\n+00013ea0: 2031 3931 362e 3434 2c2d 3633 312e 3733 1916.44,-631.73\n+00013eb0: 2031 3836 392e 3536 2c2d 3538 312e 3833 1869.56,-581.83\n+00013ec0: 2031 3836 312e 3934 2c2d 3537 332e 3732 1861.94,-573.72\n+00013ed0: 2031 3732 322e 3634 2c2d 3436 322e 3533 1722.64,-462.53\n+00013ee0: 2031 3731 332e 3536 2c2d 3435 362e 3039 1713.56,-456.09\n+00013ef0: 2031 3638 382e 3831 2c2d 3433 382e 3534 1688.81,-438.54\n+00013f00: 2031 3637 342e 3839 2c2d 3434 332e 3437 1674.89,-443.47\n+00013f10: 2031 3635 352e 3536 2c2d 3432 302e 3039 1655.56,-420.09\n+00013f20: 2031 3632 362e 3936 2c2d 3338 352e 3520 1626.96,-385.5 \n+00013f30: 3136 3132 2e37 322c 2d33 3333 2e37 3820 1612.72,-333.78 \n+00013f40: 3136 3039 2e34 312c 2d33 3034 2e34 3122 1609.41,-304.41\"\n+00013f50: 2f3e 0a3c 706f 6c79 676f 6e20 6669 6c6c />.<polygon fill\n+00013f60: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+00013f70: 653d 2223 3238 3266 6363 2220 706f 696e e=\"#282fcc\" poin\n+00013f80: 7473 3d22 3136 3132 2e38 392c 2d33 3034 ts=\"1612.89,-304\n+00013f90: 2e30 3520 3136 3038 2e36 372c 2d32 3934 .05 1608.67,-294\n+00013fa0: 2e33 3320 3136 3035 2e39 312c 2d33 3034 .33 1605.91,-304\n+00013fb0: 2e35 3620 3136 3132 2e38 392c 2d33 3034 .56 1612.89,-304\n+00013fc0: 2e30 3522 2f3e 0a3c 2f67 3e0a 3c21 2d2d .05\"/>.</g>.<!--\n+00013fd0: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n+00013fe0: 6163 735f 6d64 7479 7065 7326 2334 353b acs_mdtypes-\n+00013ff0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+00014000: 726f 6d61 6373 5f61 7070 6c69 6564 5f66 romacs_applied_f\n+00014010: 6f72 6365 735f 6177 6820 2d2d 3e0a 3c67 orces_awh -->.<g\n+00014020: 2069 643d 2265 6467 6531 3233 2220 636c id=\"edge123\" cl\n+00014030: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.<tit\n+00014040: 6c65 3e6d 6f64 756c 655f 7372 635f 6772 le>module_src_gr\n+00014050: 6f6d 6163 735f 6d64 7479 7065 7326 2334 omacs_mdtypes\n+00014060: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+00014070: 5f67 726f 6d61 6373 5f61 7070 6c69 6564 _gromacs_applied\n+00014080: 5f66 6f72 6365 735f 6177 683c 2f74 6974 _forces_awh</tit\n+00014090: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n+000140a0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n+000140b0: 3832 6663 6322 2073 7472 6f6b 652d 6461 82fcc\" stroke-da\n+000140c0: 7368 6172 7261 793d 2235 2c32 2220 643d sharray=\"5,2\" d=\n+000140d0: 224d 3138 3835 2e39 342c 2d39 3037 2e33 \"M1885.94,-907.3\n+000140e0: 3143 3136 3831 2e38 372c 2d38 3939 2e39 1C1681.87,-899.9\n+000140f0: 3520 3731 362e 3938 2c2d 3836 332e 3836 5 716.98,-863.86\n+00014100: 2036 3836 2e35 362c 2d38 3630 2e31 3820 686.56,-860.18 \n+00014110: 3637 392e 3934 2c2d 3835 392e 3338 2036 679.94,-859.38 6\n+00014120: 3732 2e39 372c 2d38 3538 2e32 3420 3636 72.97,-858.24 66\n+00014130: 362e 3333 2c2d 3835 362e 3938 222f 3e0a 6.33,-856.98\"/>.\n+00014140: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 <polygon fill=\"#\n+00014150: 3238 3266 6363 2220 7374 726f 6b65 3d22 282fcc\" stroke=\"\n+00014160: 2332 3832 6663 6322 2070 6f69 6e74 733d #282fcc\" points=\n+00014170: 2236 3636 2e37 352c 2d38 3533 2e35 2036 \"666.75,-853.5 6\n+00014180: 3536 2e32 352c 2d38 3534 2e39 3220 3636 56.25,-854.92 66\n+00014190: 352e 3335 2c2d 3836 302e 3335 2036 3636 5.35,-860.35 666\n+000141a0: 2e37 352c 2d38 3533 2e35 222f 3e0a 3c2f .75,-853.5\"/>.</\n+000141b0: 673e 0a3c 212d 2d20 6d6f 6475 6c65 5f73 g>.<!-- module_s\n+000141c0: 7263 5f67 726f 6d61 6373 5f67 6d78 7072 rc_gromacs_gmxpr\n+000141d0: 6570 726f 6365 7373 2623 3435 3b26 6774 eprocess->\n+000141e0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+000141f0: 6163 735f 6d64 7275 6e75 7469 6c69 7479 acs_mdrunutility\n+00014200: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n+00014210: 3133 3322 2063 6c61 7373 3d22 6564 6765 133\" class=\"edge\n+00014220: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n+00014230: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n+00014240: 7072 6570 726f 6365 7373 2623 3435 3b26 preprocess-&\n+00014250: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00014260: 6f6d 6163 735f 6d64 7275 6e75 7469 6c69 omacs_mdrunutili\n+00014270: 7479 3c2f 7469 746c 653e 0a3c 7061 7468 ty..<\n+00014300: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+00014310: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+00014320: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+00014330: 3135 3831 2e36 362c 2d31 3130 382e 3334 1581.66,-1108.34\n+00014340: 2031 3539 312e 3234 2c2d 3131 3033 2e38 1591.24,-1103.8\n+00014350: 2031 3538 302e 3933 2c2d 3131 3031 2e33 1580.93,-1101.3\n+00014360: 3720 3135 3831 2e36 362c 2d31 3130 382e 7 1581.66,-1108.\n+00014370: 3334 222f 3e0a 3c2f 673e 0a3c 212d 2d20 34\"/>....modu\n+000143f0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+00014400: 6d78 7072 6570 726f 6365 7373 2623 3435 mxpreprocess-\n+00014410: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00014420: 6772 6f6d 6163 735f 7261 6e64 6f6d 3c2f gromacs_random</\n+00014430: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+00014440: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+00014450: 2262 6c61 636b 2220 7374 726f 6b65 2d64 \"black\" stroke-d\n+00014460: 6173 6861 7272 6179 3d22 352c 3222 2064 asharray=\"5,2\" d\n+00014470: 3d22 4d39 3939 2e38 352c 2d31 3135 392e =\"M999.85,-1159.\n+00014480: 3936 4338 3531 2e33 322c 2d31 3135 392e 96C851.32,-1159.\n+00014490: 3032 2034 3633 2e37 372c 2d31 3135 322e 02 463.77,-1152.\n+000144a0: 3539 2033 3432 2e35 362c 2d31 3131 312e 59 342.56,-1111.\n+000144b0: 3636 2032 3835 2e30 332c 2d31 3039 322e 66 285.03,-1092.\n+000144c0: 3233 2032 3238 2e35 362c 2d31 3039 372e 23 228.56,-1097.\n+000144d0: 3038 2032 3238 2e35 362c 2d31 3033 362e 08 228.56,-1036.\n+000144e0: 3336 2032 3238 2e35 362c 2d31 3033 362e 36 228.56,-1036.\n+000144f0: 3336 2032 3238 2e35 362c 2d31 3033 362e 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_listed_forces</\n+000146d0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+000146e0: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+000146f0: 2223 3238 3266 6363 2220 7374 726f 6b65 \"#282fcc\" stroke\n+00014700: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n+00014710: 2064 3d22 4d31 3131 362e 352c 2d31 3135 d=\"M1116.5,-115\n+00014720: 382e 3638 4331 3336 302e 3336 2c2d 3131 8.68C1360.36,-11\n+00014730: 3532 2e32 3920 3232 3935 2e36 382c 2d31 52.29 2295.68,-1\n+00014740: 3132 332e 3038 2032 3430 322e 3536 2c2d 123.08 2402.56,-\n+00014750: 3130 3438 2e37 3920 3234 3333 2e33 342c 1048.79 2433.34,\n+00014760: 2d31 3032 372e 3339 2032 3434 302e 3536 -1027.39 2440.56\n+00014770: 2c2d 3130 3130 2e39 3720 3234 3430 2e35 ,-1010.97 2440.5\n+00014780: 362c 2d39 3733 2e34 3920 3234 3430 2e35 6,-973.49 2440.5\n+00014790: 362c 2d39 3733 2e34 3920 3234 3430 2e35 6,-973.49 2440.5\n+000147a0: 362c 2d39 3733 2e34 3920 3234 3430 2e35 6,-973.49 2440.5\n+000147b0: 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6f64 756c 655f /g>.<!-- module_\n+000148a0: 7372 635f 6772 6f6d 6163 735f 676d 7870 src_gromacs_gmxp\n+000148b0: 7265 7072 6f63 6573 7326 2334 353b 2667 reprocess-&g\n+000148c0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+000148d0: 6d61 6373 5f6f 7074 696f 6e73 202d 2d3e macs_options -->\n+000148e0: 0a3c 6720 6964 3d22 6564 6765 3134 3022 .<g id=\"edge140\"\n+000148f0: 2063 6c61 7373 3d22 6564 6765 223e 0a3c class=\"edge\">.<\n+00014900: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+00014910: 5f67 726f 6d61 6373 5f67 6d78 7072 6570 _gromacs_gmxprep\n+00014920: 726f 6365 7373 2623 3435 3b26 6774 3b6d rocess->m\n+00014930: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00014940: 735f 6f70 7469 6f6e 733c 2f74 6974 6c65 s_options</title\n+00014950: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+00014960: 6e65 2220 7374 726f 6b65 3d22 2332 3832 ne\" stroke=\"#282\n+00014970: 6663 6322 2073 7472 6f6b 652d 6461 7368 fcc\" stroke-dash\n+00014980: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n+00014990: 3130 3134 2e34 352c 2d31 3135 322e 3131 1014.45,-1152.11\n+000149a0: 4338 3833 2e37 2c2d 3131 3236 2e30 3520 C883.7,-1126.05 \n+000149b0: 3531 312e 3632 2c2d 3130 3333 2e33 3620 511.62,-1033.36 \n+000149c0: 3538 322e 3536 2c2d 3833 332e 3331 2035 582.56,-833.31 5\n+000149d0: 3937 2e31 2c2d 3739 322e 3331 2038 3735 97.1,-792.31 875\n+000149e0: 2e37 392c 2d34 3531 2e33 3820 3935 372e .79,-451.38 957.\n+000149f0: 3536 2c2d 3339 332e 3232 2031 3033 392e 56,-393.22 1039.\n+00014a00: 3931 2c2d 3333 342e 3634 2031 3135 362e 91,-334.64 1156.\n+00014a10: 3735 2c2d 3330 332e 3033 2031 3231 372e 75,-303.03 1217.\n+00014a20: 3039 2c2d 3238 392e 3639 222f 3e0a 3c70 09,-289.69\"/>.<p\n+00014a30: 6f6c 7967 6f6e 2066 696c 6c3d 2223 3238 olygon fill=\"#28\n+00014a40: 3266 6363 2220 7374 726f 6b65 3d22 2332 2fcc\" stroke=\"#2\n+00014a50: 3832 6663 6322 2070 6f69 6e74 733d 2231 82fcc\" points=\"1\n+00014a60: 3231 372e 3934 2c2d 3239 332e 3039 2031 217.94,-293.09 1\n+00014a70: 3232 362e 3938 2c2d 3238 372e 3536 2031 226.98,-287.56 1\n+00014a80: 3231 362e 3436 2c2d 3238 362e 3235 2031 216.46,-286.25 1\n+00014a90: 3231 372e 3934 2c2d 3239 332e 3039 222f 217.94,-293.09\"/\n+00014aa0: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >.</g>.<!-- modu\n+00014ab0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+00014ac0: 6d78 7072 6570 726f 6365 7373 2623 3435 mxpreprocess-\n+00014ad0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00014ae0: 6772 6f6d 6163 735f 6666 7420 2d2d 3e0a gromacs_fft -->.\n+00014af0: 3c67 2069 643d 2265 6467 6531 3239 2220 <g id=\"edge129\" \n+00014b00: 636c 6173 733d 2265 6467 6522 3e0a 3c74 class=\"edge\">.<t\n+00014b10: 6974 6c65 3e6d 6f64 756c 655f 7372 635f itle>module_src_\n+00014b20: 6772 6f6d 6163 735f 676d 7870 7265 7072 gromacs_gmxprepr\n+00014b30: 6f63 6573 7326 2334 353b 2667 743b 6d6f ocess->mo\n+00014b40: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00014b50: 5f66 6674 3c2f 7469 746c 653e 0a3c 7061 _fft...\n+00014d20: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...module_src_grom\n+00014da0: 6163 735f 676d 7870 7265 7072 6f63 6573 acs_gmxpreproces\n+00014db0: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n+00014dc0: 5f73 7263 5f67 726f 6d61 6373 5f6d 6472 _src_gromacs_mdr\n+00014dd0: 756e 3c2f 7469 746c 653e 0a3c 7061 7468 un..\n+00014ff0: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ...<\n+00015040: 6720 6964 3d22 6564 6765 3133 3022 2063 g id=\"edge130\" c\n+00015050: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+00015070: 726f 6d61 6373 5f67 6d78 7072 6570 726f romacs_gmxprepro\n+00015080: 6365 7373 2623 3435 3b26 6774 3b6d 6f64 cess->mod\n+00015090: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000150a0: 696d 643c 2f74 6974 6c65 3e0a 3c70 6174 imd......module\n+000152d0: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n+000152e0: 7072 6570 726f 6365 7373 2623 3435 3b26 preprocess-&\n+000152f0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00015300: 6f6d 6163 735f 676d 7861 6e61 3c2f 7469 omacs_gmxana</ti\n+00015310: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n+00015320: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n+00015330: 6266 6266 6266 2220 643d 224d 3130 3138 bfbfbf\" d=\"M1018\n+00015340: 2e33 382c 2d31 3135 312e 3243 3939 342e .38,-1151.2C994.\n+00015350: 3132 2c2d 3131 3434 2e30 3520 3936 342e 12,-1144.05 964.\n+00015360: 3033 2c2d 3131 3331 2e37 3820 3934 332e 03,-1131.78 943.\n+00015370: 3536 2c2d 3131 3131 2e36 3620 3931 302e 56,-1111.66 910.\n+00015380: 3538 2c2d 3130 3739 2e32 3420 3839 342e 58,-1079.24 894.\n+00015390: 3039 2c2d 3130 3235 2e39 3220 3838 372e 09,-1025.92 887.\n+000153a0: 3032 2c2d 3939 352e 3838 222f 3e0a 3c70 02,-995.88\"/>.<p\n+000153b0: 6f6c 7967 6f6e 2066 696c 6c3d 2223 6266 olygon fill=\"#bf\n+000153c0: 6266 6266 2220 7374 726f 6b65 3d22 2362 bfbf\" stroke=\"#b\n+000153d0: 6662 6662 6622 2070 6f69 6e74 733d 2238 fbfbf\" points=\"8\n+000153e0: 3930 2e34 2c2d 3939 342e 3936 2038 3834 90.4,-994.96 884\n+000153f0: 2e38 332c 2d39 3835 2e39 3420 3838 332e .83,-985.94 883.\n+00015400: 3537 2c2d 3939 362e 3436 2038 3930 2e34 57,-996.46 890.4\n+00015410: 2c2d 3939 342e 3936 222f 3e0a 3c2f 673e ,-994.96\"/>.</g>\n+00015420: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 .<!-- module_src\n+00015430: 5f67 726f 6d61 6373 5f67 6d78 7072 6570 _gromacs_gmxprep\n+00015440: 726f 6365 7373 2623 3435 3b26 6774 3b6d rocess->m\n+00015450: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00015460: 735f 676d 786c 6962 202d 2d3e 0a3c 6720 s_gmxlib -->.<g \n+00015470: 6964 3d22 6564 6765 3133 3722 2063 6c61 id=\"edge137\" cla\n+00015480: 7373 3d22 6564 6765 223e 0a3c 7469 746c ss=\"edge\">.<titl\n+00015490: 653e 6d6f 6475 6c65 5f73 7263 5f67 726f e>module_src_gro\n+000154a0: 6d61 6373 5f67 6d78 7072 6570 726f 6365 macs_gmxpreproce\n+000154b0: 7373 2623 3435 3b26 6774 3b6d 6f64 756c ss->modul\n+000154c0: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n+000154d0: 786c 6962 3c2f 7469 746c 653e 0a3c 7061 xlib...<\n+000155f0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.\n+00015640: 0a3c 6720 6964 3d22 6564 6765 3133 3422 ..<\n+00015660: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+00015670: 5f67 726f 6d61 6373 5f67 6d78 7072 6570 _gromacs_gmxprep\n+00015680: 726f 6365 7373 2623 3435 3b26 6774 3b6d rocess->m\n+00015690: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+000156a0: 735f 6d64 7479 7065 733c 2f74 6974 6c65 s_mdtypes.\n+00015780: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....\n+00015ab0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00015ac0: 6373 5f67 6d78 7072 6570 726f 6365 7373 cs_gmxpreprocess\n+00015ad0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+00015ae0: 7372 635f 6772 6f6d 6163 735f 6669 6c65 src_gromacs_file\n+00015af0: 696f 3c2f 7469 746c 653e 0a3c 7061 7468 io...\n+00015cc0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...module_src_gro\n+00015d40: 6d61 6373 5f67 6d78 7072 6570 726f 6365 macs_gmxpreproce\n+00015d50: 7373 2623 3435 3b26 6774 3b6d 6f64 756c ss->modul\n+00015d60: 655f 7372 635f 6772 6f6d 6163 735f 646f e_src_gromacs_do\n+00015d70: 6d64 6563 3c2f 7469 746c 653e 0a3c 7061 mdec..\n+00015e60: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....mo\n+00015f50: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00015f60: 5f67 6d78 7072 6570 726f 6365 7373 2623 _gmxpreprocess&#\n+00015f70: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+00015f80: 635f 6772 6f6d 6163 735f 636f 6d6d 616e c_gromacs_comman\n+00015f90: 646c 696e 653c 2f74 6974 6c65 3e0a 3c70 dline..<\n+00016080: 706f 6c79 676f 6e20 6669 6c6c 3d22 626c polygon fill=\"bl\n+00016090: 6163 6b22 2073 7472 6f6b 653d 2262 6c61 ack\" stroke=\"bla\n+000160a0: 636b 2220 706f 696e 7473 3d22 3133 3636 ck\" points=\"1366\n+000160b0: 2e38 312c 2d37 3431 2e39 3220 3133 3539 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6177 683c 2f74 6974 6c65 orces_awh</title\n+00016470: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+00016480: 6e65 2220 7374 726f 6b65 3d22 2332 3832 ne\" stroke=\"#282\n+00016490: 6663 6322 2073 7472 6f6b 652d 6461 7368 fcc\" stroke-dash\n+000164a0: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n+000164b0: 3130 3138 2e39 332c 2d31 3135 312e 3143 1018.93,-1151.1C\n+000164c0: 3938 392e 382c 2d31 3134 332e 3420 3934 989.8,-1143.4 94\n+000164d0: 392e 3938 2c2d 3131 3330 2e35 3320 3931 9.98,-1130.53 91\n+000164e0: 382e 3536 2c2d 3131 3131 2e36 3620 3830 8.56,-1111.66 80\n+000164f0: 302e 3939 2c2d 3130 3431 2e30 3420 3639 0.99,-1041.04 69\n+00016500: 302e 3635 2c2d 3931 352e 3634 2036 3530 0.65,-915.64 650\n+00016510: 2e35 322c 2d38 3637 2e34 222f 3e0a 3c70 .52,-867.4\"/>.<p\n+00016520: 6f6c 7967 6f6e 2066 696c 6c3d 2223 3238 olygon fill=\"#28\n+00016530: 3266 6363 2220 7374 726f 6b65 3d22 2332 2fcc\" stroke=\"#2\n+00016540: 3832 6663 6322 2070 6f69 6e74 733d 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nt-size=\"10.00\">\n+00016710: 7465 7374 7574 696c 733c 2f74 6578 743e testutils</text>\n+00016720: 0a3c 2f61 3e0a 3c2f 673e 0a3c 2f67 3e0a .</a>.</g>.</g>.\n+00016730: 3c21 2d2d 206d 6f64 756c 655f 7372 635f <!-- module_src_\n+00016740: 6772 6f6d 6163 735f 676d 7870 7265 7072 gromacs_gmxprepr\n+00016750: 6f63 6573 7326 2334 353b 2667 743b 6d6f ocess->mo\n+00016760: 6475 6c65 5f73 7263 5f74 6573 7475 7469 dule_src_testuti\n+00016770: 6c73 202d 2d3e 0a3c 6720 6964 3d22 6564 ls -->.<g id=\"ed\n+00016780: 6765 3134 3122 2063 6c61 7373 3d22 6564 ge141\" class=\"ed\n+00016790: 6765 223e 0a3c 7469 746c 653e 6d6f 6475 ge\">.<title>modu\n+000167a0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+000167b0: 6d78 7072 6570 726f 6365 7373 2623 3435 mxpreprocess-\n+000167c0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+000167d0: 7465 7374 7574 696c 733c 2f74 6974 6c65 testutils</title\n+000167e0: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+000167f0: 6e65 2220 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322e 5,-1104.62 2772.\n+000168e0: 3538 2c2d 3131 3131 2e34 3322 2f3e 0a3c 58,-1111.43\"/>.<\n+000168f0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.<!-- module_\n+00016900: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n+00016910: 6226 2334 353b 2667 743b 6d6f 6475 6c65 b->module\n+00016920: 5f73 7263 5f67 726f 6d61 6373 5f6d 6472 _src_gromacs_mdr\n+00016930: 756e 7574 696c 6974 7920 2d2d 3e0a 3c67 unutility -->.<g\n+00016940: 2069 643d 2265 6467 6531 3533 2220 636c id=\"edge153\" cl\n+00016950: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.<tit\n+00016960: 6c65 3e6d 6f64 756c 655f 7372 635f 6772 le>module_src_gr\n+00016970: 6f6d 6163 735f 6d64 6c69 6226 2334 353b omacs_mdlib-\n+00016980: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+00016990: 726f 6d61 6373 5f6d 6472 756e 7574 696c romacs_mdrunutil\n+000169a0: 6974 793c 2f74 6974 6c65 3e0a 3c70 6174 ity..\n+00016be0: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....m\n+00016c50: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00016c60: 735f 6d64 6c69 6226 2334 353b 2667 743b s_mdlib->\n+00016c70: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00016c80: 6373 5f72 616e 646f 6d3c 2f74 6974 6c65 cs_random</title\n+00016c90: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+00016ca0: 6e65 2220 7374 726f 6b65 3d22 626c 6163 ne\" stroke=\"blac\n+00016cb0: 6b22 2073 7472 6f6b 652d 6461 7368 6172 k\" stroke-dashar\n+00016cc0: 7261 793d 2235 2c32 2220 643d 224d 3135 ray=\"5,2\" d=\"M15\n+00016cd0: 3036 2e36 2c2d 3231 352e 3335 4331 3336 06.6,-215.35C136\n+00016ce0: 362e 3839 2c2d 3230 362e 3920 3734 342e 6.89,-206.9 744.\n+00016cf0: 3233 2c2d 3136 392e 3232 2035 3732 2e35 23,-169.22 572.5\n+00016d00: 332c 2d31 3538 2e38 3422 2f3e 0a3c 706f 3,-158.84\"/>.<po\n+00016d10: 6c79 676f 6e20 6669 6c6c 3d22 626c 6163 lygon fill=\"blac\n+00016d20: 6b22 2073 7472 6f6b 653d 2262 6c61 636b k\" stroke=\"black\n+00016d30: 2220 706f 696e 7473 3d22 3537 322e 3534 \" points=\"572.54\n+00016d40: 2c2d 3135 352e 3333 2035 3632 2e33 352c ,-155.33 562.35,\n+00016d50: 2d31 3538 2e32 3220 3537 322e 3132 2c2d -158.22 572.12,-\n+00016d60: 3136 322e 3332 2035 3732 2e35 342c 2d31 162.32 572.54,-1\n+00016d70: 3535 2e33 3322 2f3e 0a3c 2f67 3e0a 3c21 55.33\"/>.</g>.<!\n+00016d80: 2d2d 206d 6f64 756c 655f 7372 635f 6772 -- module_src_gr\n+00016d90: 6f6d 6163 735f 6d64 6c69 6226 2334 353b omacs_mdlib-\n+00016da0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+00016db0: 726f 6d61 6373 5f67 7075 5f75 7469 6c73 romacs_gpu_utils\n+00016dc0: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n+00016dd0: 3134 3222 2063 6c61 7373 3d22 6564 6765 142\" class=\"edge\n+00016de0: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n+00016df0: 5f73 7263 5f67 726f 6d61 6373 5f6d 646c _src_gromacs_mdl\n+00016e00: 6962 2623 3435 3b26 6774 3b6d 6f64 756c ib->modul\n+00016e10: 655f 7372 635f 6772 6f6d 6163 735f 6770 e_src_gromacs_gp\n+00016e20: 755f 7574 696c 733c 2f74 6974 6c65 3e0a u_utils.\n+00016e30: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ..<\n+00016f60: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...mod\n+00016fd0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00016fe0: 6d64 6c69 6226 2334 353b 2667 743b 6d6f mdlib->mo\n+00016ff0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00017000: 5f74 6162 6c65 733c 2f74 6974 6c65 3e0a _tables.\n+00017010: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ...<\n+00017100: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+00017110: 726f 6d61 6373 5f6d 646c 6962 2623 3435 romacs_mdlib-\n+00017120: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00017130: 6772 6f6d 6163 735f 6861 7264 7761 7265 gromacs_hardware\n+00017140: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->..module\n+00017170: 5f73 7263 5f67 726f 6d61 6373 5f6d 646c _src_gromacs_mdl\n+00017180: 6962 2623 3435 3b26 6774 3b6d 6f64 756c ib->modul\n+00017190: 655f 7372 635f 6772 6f6d 6163 735f 6861 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7.3\"/>..<\n+000173e0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>..<\n+00017430: 6720 6964 3d22 6564 6765 3134 3522 2063 g id=\"edge145\" c\n+00017440: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+00017460: 726f 6d61 6373 5f6d 646c 6962 2623 3435 romacs_mdlib-\n+00017470: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+00017480: 6772 6f6d 6163 735f 6c69 7374 6564 5f66 gromacs_listed_f\n+00017490: 6f72 6365 733c 2f74 6974 6c65 3e0a 3c70 orces..<\n+00017520: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+00017530: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+00017540: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+00017550: 3230 3937 2e39 352c 2d31 3634 2e38 3620 2097.95,-164.86 \n+00017560: 3231 3037 2e35 382c 2d31 3630 2e34 3320 2107.58,-160.43 \n+00017570: 3230 3937 2e32 392c 2d31 3537 2e38 3920 2097.29,-157.89 \n+00017580: 3230 3937 2e39 352c 2d31 3634 2e38 3622 2097.95,-164.86\"\n+00017590: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />....\n+00017600: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00017610: 6373 5f6d 646c 6962 2623 3435 3b26 6774 cs_mdlib->\n+00017620: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+00017630: 6163 735f 6e62 6e78 6d3c 2f74 6974 6c65 acs_nbnxm</title\n+00017640: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+00017650: 6e65 2220 7374 726f 6b65 3d22 7265 6422 ne\" stroke=\"red\"\n+00017660: 2064 3d22 4d31 3536 302e 3639 2c2d 3231 d=\"M1560.69,-21\n+00017670: 322e 3536 4331 3633 392e 3836 2c2d 3230 2.56C1639.86,-20\n+00017680: 302e 3232 2031 3838 322e 3836 2c2d 3136 0.22 1882.86,-16\n+00017690: 352e 3132 2032 3038 352e 3536 2c2d 3134 5.12 2085.56,-14\n+000176a0: 312e 3734 2032 3235 392e 3535 2c2d 3132 1.74 2259.55,-12\n+000176b0: 312e 3637 2032 3436 382e 3036 2c2d 3130 1.67 2468.06,-10\n+000176c0: 332e 3435 2032 3535 352e 3732 2c2d 3936 3.45 2555.72,-96\n+000176d0: 2e34 222f 3e0a 3c70 6f6c 7967 6f6e 2066 .4\"/>.<polygon 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2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+000177d0: 7263 5f67 726f 6d61 6373 5f69 6d64 3c2f rc_gromacs_imd</\n+000177e0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+000177f0: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+00017800: 2223 3238 3266 6363 2220 7374 726f 6b65 \"#282fcc\" stroke\n+00017810: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n+00017820: 2064 3d22 4d31 3530 362e 372c 2d32 3134 d=\"M1506.7,-214\n+00017830: 2e39 4331 3437 382e 3532 2c2d 3231 322e .9C1478.52,-212.\n+00017840: 3335 2031 3433 342e 3433 2c2d 3230 382e 35 1434.43,-208.\n+00017850: 3032 2031 3339 362e 3536 2c2d 3230 342e 02 1396.56,-204.\n+00017860: 3631 2031 3139 352e 3532 2c2d 3138 362e 61 1195.52,-186.\n+00017870: 3438 2039 3534 2e38 372c 2d31 3636 2e39 48 954.87,-166.9\n+00017880: 3920 3836 342e 3737 2c2d 3135 392e 3433 9 864.77,-159.43\n+00017890: 222f 3e0a 3c70 6f6c 7967 6f6e 2066 696c \"/>.<polygon fil\n+000178a0: 6c3d 2223 3238 3266 6363 2220 7374 726f l=\"#282fcc\" stro\n+000178b0: 6b65 3d22 2332 3832 6663 6322 2070 6f69 ke=\"#282fcc\" poi\n+000178c0: 6e74 733d 2238 3635 2e30 352c 2d31 3535 nts=\"865.05,-155\n+000178d0: 2e39 3420 3835 342e 3739 2c2d 3135 382e .94 854.79,-158.\n+000178e0: 3539 2038 3634 2e34 362c 2d31 3632 2e39 59 864.46,-162.9\n+000178f0: 3220 3836 352e 3035 2c2d 3135 352e 3934 2 865.05,-155.94\n+00017900: 222f 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f \"/>.</g>.<!-- mo\n+00017910: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00017920: 5f6d 646c 6962 2623 3435 3b26 6774 3b6d _mdlib->m\n+00017930: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00017940: 735f 676d 786c 6962 202d 2d3e 0a3c 6720 s_gmxlib -->.<g \n+00017950: 6964 3d22 6564 6765 3134 3422 2063 6c61 id=\"edge144\" cla\n+00017960: 7373 3d22 6564 6765 223e 0a3c 7469 746c ss=\"edge\">.<titl\n+00017970: 653e 6d6f 6475 6c65 5f73 7263 5f67 726f e>module_src_gro\n+00017980: 6d61 6373 5f6d 646c 6962 2623 3435 3b26 macs_mdlib-&\n+00017990: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+000179a0: 6f6d 6163 735f 676d 786c 6962 3c2f 7469 omacs_gmxlib</ti\n+000179b0: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n+000179c0: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n+000179d0: 6266 6266 6266 2220 643d 224d 3135 3130 bfbfbf\" d=\"M1510\n+000179e0: 2e39 362c 2d32 3235 2e36 3343 3134 3638 .96,-225.63C1468\n+000179f0: 2e35 342c 2d32 3337 2e36 3620 3133 3831 .54,-237.66 1381\n+00017a00: 2e30 342c 2d32 3637 2e39 3120 3133 3431 .04,-267.91 1341\n+00017a10: 2e35 362c 2d33 3330 2e33 3520 3132 3735 .56,-330.35 1275\n+00017a20: 2e33 322c 2d34 3335 2e31 3120 3132 3434 .32,-435.11 1244\n+00017a30: 2e31 312c 2d35 3134 2e34 3220 3133 3234 .11,-514.42 1324\n+00017a40: 2e35 362c 2d36 3038 2e37 2031 3434 342e .56,-608.7 1444.\n+00017a50: 3039 2c2d 3734 382e 3738 2031 3638 322c 09,-748.78 1682,\n+00017a60: 2d37 3736 2e33 3420 3137 3738 2e35 352c -776.34 1778.55,\n+00017a70: 2d37 3831 2e36 3622 2f3e 0a3c 706f 6c79 -781.66\"/>.<poly\n+00017a80: 676f 6e20 6669 6c6c 3d22 2362 6662 6662 gon fill=\"#bfbfb\n+00017a90: 6622 2073 7472 6f6b 653d 2223 6266 6266 f\" stroke=\"#bfbf\n+00017aa0: 6266 2220 706f 696e 7473 3d22 3137 3738 bf\" points=\"1778\n+00017ab0: 2e36 332c 2d37 3835 2e31 3720 3137 3838 .63,-785.17 1788\n+00017ac0: 2e37 392c 2d37 3832 2e31 3720 3137 3738 .79,-782.17 1778\n+00017ad0: 2e39 382c 2d37 3738 2e31 3820 3137 3738 .98,-778.18 1778\n+00017ae0: 2e36 332c 2d37 3835 2e31 3722 2f3e 0a3c .63,-785.17\"/>.<\n+00017af0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.<!-- module_\n+00017b00: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n+00017b10: 6226 2334 353b 2667 743b 6d6f 6475 6c65 b->module\n+00017b20: 5f73 7263 5f67 726f 6d61 6373 5f63 6f6d _src_gromacs_com\n+00017b30: 7061 7420 2d2d 3e0a 3c67 2069 643d 2265 pat -->.<g id=\"e\n+00017b40: 6467 6531 3530 2220 636c 6173 733d 2265 dge150\" class=\"e\n+00017b50: 6467 6522 3e0a 3c74 6974 6c65 3e6d 6f64 dge\">.<title>mod\n+00017b60: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+00017b70: 6d64 6c69 6226 2334 353b 2667 743b 6d6f mdlib->mo\n+00017b80: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00017b90: 5f63 6f6d 7061 743c 2f74 6974 6c65 3e0a _compat.\n+00017ba0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ..\n+00017cb0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...modul\n+00017d20: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n+00017d30: 6c69 6226 2334 353b 2667 743b 6d6f 6475 lib->modu\n+00017d40: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+00017d50: 6474 7970 6573 3c2f 7469 746c 653e 0a3c dtypes.<\n+00017d60: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n+00017d70: 2073 7472 6f6b 653d 2272 6564 2220 643d stroke=\"red\" d=\n+00017d80: 224d 3135 3632 2e37 332c 2d32 3139 2e37 \"M1562.73,-219.7\n+00017d90: 3443 3136 3130 2e37 382c 2d32 3231 2e39 4C1610.78,-221.9\n+00017da0: 3120 3137 3039 2e35 332c 2d32 3330 2e38 1 1709.53,-230.8\n+00017db0: 3320 3137 3832 2e35 362c 2d32 3637 2e34 3 1782.56,-267.4\n+00017dc0: 3820 3137 3938 2e35 362c 2d32 3735 2e35 8 1798.56,-275.5\n+00017dd0: 3120 3137 3936 2e34 332c 2d32 3836 2e35 1 1796.43,-286.5\n+00017de0: 3920 3138 3132 2e35 362c 2d32 3934 2e33 9 1812.56,-294.3\n+00017df0: 3520 3138 3939 2e34 372c 2d33 3336 2e31 5 1899.47,-336.1\n+00017e00: 3720 3139 3338 2e32 342c 2d32 3931 2e36 7 1938.24,-291.6\n+00017e10: 3120 3230 3236 2e35 362c 2d33 3330 2e33 1 2026.56,-330.3\n+00017e20: 3520 3231 3732 2e39 312c 2d33 3934 2e35 5 2172.91,-394.5\n+00017e30: 3420 3232 3131 2e36 342c 2d34 3339 2e31 4 2211.64,-439.1\n+00017e40: 3220 3232 3833 2e35 362c 2d35 3831 2e38 2 2283.56,-581.8\n+00017e50: 3320 3233 3131 2e31 372c 2d36 3336 2e36 3 2311.17,-636.6\n+00017e60: 3220 3233 3237 2e36 2c2d 3634 372e 3620 2 2327.6,-647.6 \n+00017e70: 3233 3430 2e35 362c 2d37 3037 2e35 3720 2340.56,-707.57 \n+00017e80: 3233 3538 2e35 2c2d 3739 302e 3538 2032 2358.5,-790.58 2\n+00017e90: 3330 332e 3737 2c2d 3832 372e 3038 2032 303.77,-827.08 2\n+00017ea0: 3232 352e 3536 2c2d 3836 302e 3138 2032 225.56,-860.18 2\n+00017eb0: 3134 312e 342c 2d38 3935 2e38 2032 3033 141.4,-895.8 203\n+00017ec0: 332e 3332 2c2d 3930 352e 3331 2031 3937 3.32,-905.31 197\n+00017ed0: 312e 382c 2d39 3037 2e38 222f 3e0a 3c70 1.8,-907.8\"/>.....\n+00017fb0: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 module_sr\n+00017fc0: 635f 6772 6f6d 6163 735f 6d64 6c69 6226 c_gromacs_mdlib&\n+00017fd0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00017fe0: 7263 5f67 726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n+00017ff0: 6f3c 2f74 6974 6c65 3e0a 3c70 6174 6820 o...<\n+00018160: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...mod\n+000181d0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000181e0: 6d64 6c69 6226 2334 353b 2667 743b 6d6f mdlib->mo\n+000181f0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00018200: 5f64 6f6d 6465 633c 2f74 6974 6c65 3e0a _domdec.\n+00018210: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ..\n+00018350: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...m\n+000183c0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+000183d0: 735f 6d64 6c69 6226 2334 353b 2667 743b s_mdlib->\n+000183e0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+000183f0: 6373 5f63 6f6d 6d61 6e64 6c69 6e65 3c2f cs_commandline</\n+00018400: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+00018410: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+00018420: 2262 6c61 636b 2220 7374 726f 6b65 2d64 \"black\" stroke-d\n+00018430: 6173 6861 7272 6179 3d22 352c 3222 2064 asharray=\"5,2\" d\n+00018440: 3d22 4d31 3530 362e 3733 2c2d 3232 302e =\"M1506.73,-220.\n+00018450: 3937 4331 3433 352e 3139 2c2d 3232 362e 97C1435.19,-226.\n+00018460: 3233 2031 3234 362e 3438 2c2d 3234 322e 23 1246.48,-242.\n+00018470: 3136 2031 3138 392e 3536 2c2d 3236 372e 16 1189.56,-267.\n+00018480: 3438 2031 3034 362e 3035 2c2d 3333 312e 48 1046.05,-331.\n+00018490: 3332 2031 3130 342e 3536 2c2d 3331 372e 32 1104.56,-317.\n+000184a0: 3133 2031 3130 342e 3536 2c2d 3334 322e 13 1104.56,-342.\n+000184b0: 3739 2031 3130 342e 3536 2c2d 3539 362e 79 1104.56,-596.\n+000184c0: 3237 2031 3130 342e 3536 2c2d 3539 362e 27 1104.56,-596.\n+000184d0: 3237 2031 3130 342e 3536 2c2d 3539 362e 27 1104.56,-596.\n+000184e0: 3237 2031 3130 342e 3536 2c2d 3634 342e 27 1104.56,-644.\n+000184f0: 3435 2031 3134 302e 3833 2c2d 3634 372e 45 1140.83,-647.\n+00018500: 3438 2031 3138 322e 3536 2c2d 3637 312e 48 1182.56,-671.\n+00018510: 3537 2031 3230 332e 3234 2c2d 3638 332e 57 1203.24,-683.\n+00018520: 3531 2031 3236 312e 3737 2c2d 3639 382e 51 1261.77,-698.\n+00018530: 3934 2031 3330 342e 3135 2c2d 3730 392e 94 1304.15,-709.\n+00018540: 3135 222f 3e0a 3c70 6f6c 7967 6f6e 2066 15\"/>.<polygon f\n+00018550: 696c 6c3d 2262 6c61 636b 2220 7374 726f ill=\"black\" stro\n+00018560: 6b65 3d22 626c 6163 6b22 2070 6f69 6e74 ke=\"black\" point\n+00018570: 733d 2231 3330 332e 3437 2c2d 3731 322e s=\"1303.47,-712.\n+00018580: 3538 2031 3331 342e 3031 2c2d 3731 312e 58 1314.01,-711.\n+00018590: 3439 2031 3330 352e 3039 2c2d 3730 352e 49 1305.09,-705.\n+000185a0: 3737 2031 3330 332e 3437 2c2d 3731 322e 77 1303.47,-712.\n+000185b0: 3538 222f 3e0a 3c2f 673e 0a3c 212d 2d20 58\"/>.</g>.<!-- \n+000185c0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+000185d0: 6373 5f6d 646c 6962 2623 3435 3b26 6774 cs_mdlib->\n+000185e0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+000185f0: 6163 735f 6577 616c 6420 2d2d 3e0a 3c67 acs_ewald -->.<g\n+00018600: 2069 643d 2265 6467 6531 3536 2220 636c id=\"edge156\" cl\n+00018610: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.<tit\n+00018620: 6c65 3e6d 6f64 756c 655f 7372 635f 6772 le>module_src_gr\n+00018630: 6f6d 6163 735f 6d64 6c69 6226 2334 353b omacs_mdlib-\n+00018640: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+00018650: 726f 6d61 6373 5f65 7761 6c64 3c2f 7469 romacs_ewald</ti\n+00018660: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n+00018670: 226e 6f6e 6522 2073 7472 6f6b 653d 2272 \"none\" stroke=\"r\n+00018680: 6564 2220 643d 224d 3135 3531 2e39 322c ed\" d=\"M1551.92,\n+00018690: 2d32 3238 2e37 3443 3135 3634 2e37 342c -228.74C1564.74,\n+000186a0: 2d32 3337 2e35 3320 3135 3831 2e38 312c -237.53 1581.81,\n+000186b0: 2d32 3530 2e37 3220 3135 3934 2e35 332c -250.72 1594.53,\n+000186c0: 2d32 3631 2e35 3122 2f3e 0a3c 706f 6c79 -261.51\"/>.<poly\n+000186d0: 676f 6e20 6669 6c6c 3d22 7265 6422 2073 gon fill=\"red\" s\n+000186e0: 7472 6f6b 653d 2272 6564 2220 706f 696e troke=\"red\" poin\n+000186f0: 7473 3d22 3135 3932 2e33 342c 2d32 3634 ts=\"1592.34,-264\n+00018700: 2e32 3420 3136 3032 2e31 372c 2d32 3638 .24 1602.17,-268\n+00018710: 2e31 3820 3135 3936 2e39 342c 2d32 3538 .18 1596.94,-258\n+00018720: 2e39 3620 3135 3932 2e33 342c 2d32 3634 .96 1592.34,-264\n+00018730: 2e32 3422 2f3e 0a3c 2f67 3e0a 3c21 2d2d .24\"/>.</g>.<!--\n+00018740: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n+00018750: 6163 735f 6d64 6c69 6226 2334 353b 2667 acs_mdlib-&g\n+00018760: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00018770: 6d61 6373 5f74 7261 6a65 6374 6f72 7920 macs_trajectory \n+00018780: 2d2d 3e0a 3c67 2069 643d 2265 6467 6531 -->.<g id=\"edge1\n+00018790: 3439 2220 636c 6173 733d 2265 6467 6522 49\" class=\"edge\"\n+000187a0: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n+000187b0: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n+000187c0: 6226 2334 353b 2667 743b 6d6f 6475 6c65 b->module\n+000187d0: 5f73 7263 5f67 726f 6d61 6373 5f74 7261 _src_gromacs_tra\n+000187e0: 6a65 6374 6f72 793c 2f74 6974 6c65 3e0a jectory.\n+000187f0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .....modul\n+00018970: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n+00018980: 6c69 6226 2334 353b 2667 743b 6d6f 6475 lib->modu\n+00018990: 6c65 5f73 7263 5f67 726f 6d61 6373 5f65 le_src_gromacs_e\n+000189a0: 7373 656e 7469 616c 6479 6e61 6d69 6373 ssentialdynamics\n+000189b0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......module_\n+00018df0: 7372 635f 6772 6f6d 6163 735f 6669 6c65 src_gromacs_file\n+00018e00: 696f 2623 3435 3b26 6774 3b6d 6f64 756c io->modul\n+00018e10: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n+00018e20: 7275 6e75 7469 6c69 7479 3c2f 7469 746c runutility</titl\n+00018e30: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n+00018e40: 6f6e 6522 2073 7472 6f6b 653d 2223 3238 one\" stroke=\"#28\n+00018e50: 3266 6363 2220 7374 726f 6b65 2d64 6173 2fcc\" stroke-das\n+00018e60: 6861 7272 6179 3d22 352c 3222 2064 3d22 harray=\"5,2\" d=\"\n+00018e70: 4d31 3036 332e 3037 2c2d 3636 342e 3343 M1063.07,-664.3C\n+00018e80: 3130 3731 2e33 362c 2d36 3636 2e36 3120 1071.36,-666.61 \n+00018e90: 3130 3830 2e33 382c 2d36 3639 2e33 3220 1080.38,-669.32 \n+00018ea0: 3130 3838 2e35 362c 2d36 3731 2e35 3720 1088.56,-671.57 \n+00018eb0: 3131 3533 2c2d 3638 392e 3238 2031 3137 1153,-689.28 117\n+00018ec0: 382e 3839 2c2d 3637 302e 3539 2031 3233 8.89,-670.59 123\n+00018ed0: 342e 3536 2c2d 3730 372e 3537 2031 3234 4.56,-707.57 124\n+00018ee0: 362e 3936 2c2d 3731 352e 3831 2031 3234 6.96,-715.81 124\n+00018ef0: 322e 382c 2d37 3235 2e33 3220 3132 3534 2.8,-725.32 1254\n+00018f00: 2e35 362c 2d37 3334 2e34 3420 3132 3837 .56,-734.44 1287\n+00018f10: 2e39 352c 2d37 3630 2e33 3420 3133 3036 .95,-760.34 1306\n+00018f20: 2e34 352c 2d37 3438 2e34 3920 3133 3432 .45,-748.49 1342\n+00018f30: 2e35 362c 2d37 3730 2e34 3420 3134 3835 .56,-770.44 1485\n+00018f40: 2e36 362c 2d38 3537 2e34 3520 3134 3834 .66,-857.45 1484\n+00018f50: 2e34 382c 2d39 3234 2e33 3420 3135 3936 .48,-924.34 1596\n+00018f60: 2e35 362c 2d31 3034 382e 3739 2031 3630 .56,-1048.79 160\n+00018f70: 352e 3132 2c2d 3130 3538 2e32 3920 3136 5.12,-1058.29 16\n+00018f80: 3134 2e39 322c 2d31 3036 382e 3439 2031 14.92,-1068.49 1\n+00018f90: 3632 322e 3635 2c2d 3130 3737 2e30 3722 622.65,-1077.07\"\n+00018fa0: 2f3e 0a3c 706f 6c79 676f 6e20 6669 6c6c />.<polygon fill\n+00018fb0: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+00018fc0: 653d 2223 3238 3266 6363 2220 706f 696e e=\"#282fcc\" poin\n+00018fd0: 7473 3d22 3136 3230 2e31 312c 2d31 3037 ts=\"1620.11,-107\n+00018fe0: 392e 3439 2031 3632 392e 3333 2c2d 3130 9.49 1629.33,-10\n+00018ff0: 3834 2e37 3220 3136 3235 2e33 392c 2d31 84.72 1625.39,-1\n+00019000: 3037 342e 3839 2031 3632 302e 3131 2c2d 074.89 1620.11,-\n+00019010: 3130 3739 2e34 3922 2f3e 0a3c 2f67 3e0a 1079.49\"/>.</g>.\n+00019020: 3c21 2d2d 206d 6f64 756c 655f 7372 635f <!-- module_src_\n+00019030: 6772 6f6d 6163 735f 6669 6c65 696f 2623 gromacs_fileio&#\n+00019040: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+00019050: 635f 6772 6f6d 6163 735f 6d64 7370 616e c_gromacs_mdspan\n+00019060: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n+00019070: 3136 3022 2063 6c61 7373 3d22 6564 6765 160\" class=\"edge\n+00019080: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n+00019090: 5f73 7263 5f67 726f 6d61 6373 5f66 696c _src_gromacs_fil\n+000190a0: 6569 6f26 2334 353b 2667 743b 6d6f 6475 eio->modu\n+000190b0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+000190c0: 6473 7061 6e3c 2f74 6974 6c65 3e0a 3c70 dspan...<\n+00019220: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...mo\n+00019290: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000192a0: 5f66 696c 6569 6f26 2334 353b 2667 743b _fileio->\n+000192b0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+000192c0: 6373 5f67 6d78 6c69 623c 2f74 6974 6c65 cs_gmxlib</title\n+000192d0: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+000192e0: 6e65 2220 7374 726f 6b65 3d22 2362 6662 ne\" stroke=\"#bfb\n+000192f0: 6662 6622 2064 3d22 4d31 3036 302e 3537 fbf\" d=\"M1060.57\n+00019300: 2c2d 3636 362e 3237 4331 3036 362e 3639 ,-666.27C1066.69\n+00019310: 2c2d 3636 382e 3132 2031 3037 332e 3335 ,-668.12 1073.35\n+00019320: 2c2d 3637 302e 3033 2031 3037 392e 3536 ,-670.03 1079.56\n+00019330: 2c2d 3637 312e 3537 2031 3136 312e 3239 ,-671.57 1161.29\n+00019340: 2c2d 3639 312e 3832 2031 3139 312e 3932 ,-691.82 1191.92\n+00019350: 2c2d 3636 362e 3734 2031 3236 352e 3536 ,-666.74 1265.56\n+00019360: 2c2d 3730 372e 3537 2031 3237 392e 3833 ,-707.57 1279.83\n+00019370: 2c2d 3731 352e 3438 2031 3237 352e 3932 ,-715.48 1275.92\n+00019380: 2c2d 3732 372e 3235 2031 3239 302e 3536 ,-727.25 1290.56\n+00019390: 2c2d 3733 342e 3434 2031 3333 342e 3034 ,-734.44 1334.04\n+000193a0: 2c2d 3735 352e 3738 2031 3636 312e 3833 ,-755.78 1661.83\n+000193b0: 2c2d 3737 342e 3636 2031 3737 392e 3034 ,-774.66 1779.04\n+000193c0: 2c2d 3738 302e 3739 222f 3e0a 3c70 6f6c ,-780.79\"/>.<pol\n+000193d0: 7967 6f6e 2066 696c 6c3d 2223 6266 6266 ygon fill=\"#bfbf\n+000193e0: 6266 2220 7374 726f 6b65 3d22 2362 6662 bf\" stroke=\"#bfb\n+000193f0: 6662 6622 2070 6f69 6e74 733d 2231 3737 fbf\" points=\"177\n+00019400: 382e 392c 2d37 3834 2e32 3820 3137 3839 8.9,-784.28 1789\n+00019410: 2e30 372c 2d37 3831 2e33 3120 3137 3739 .07,-781.31 1779\n+00019420: 2e32 362c 2d37 3737 2e32 3920 3137 3738 .26,-777.29 1778\n+00019430: 2e39 2c2d 3738 342e 3238 222f 3e0a 3c2f .9,-784.28\"/>.</\n+00019440: 673e 0a3c 212d 2d20 6d6f 6475 6c65 5f73 g>.<!-- module_s\n+00019450: 7263 5f67 726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n+00019460: 6f26 2334 353b 2667 743b 6d6f 6475 6c65 o->module\n+00019470: 5f73 7263 5f67 726f 6d61 6373 5f63 6f6d _src_gromacs_com\n+00019480: 7061 7420 2d2d 3e0a 3c67 2069 643d 2265 pat -->.<g id=\"e\n+00019490: 6467 6531 3633 2220 636c 6173 733d 2265 dge163\" class=\"e\n+000194a0: 6467 6522 3e0a 3c74 6974 6c65 3e6d 6f64 dge\">.<title>mod\n+000194b0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000194c0: 6669 6c65 696f 2623 3435 3b26 6774 3b6d fileio->m\n+000194d0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+000194e0: 735f 636f 6d70 6174 3c2f 7469 746c 653e s_compat\n+000194f0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ..\n+00019670: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module_src_grom\n+000196f0: 6163 735f 6669 6c65 696f 2623 3435 3b26 acs_fileio-&\n+00019700: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00019710: 6f6d 6163 735f 6d64 7479 7065 733c 2f74 omacs_mdtypes.....\n+000198d0: 3c67 2069 643d 2265 6467 6531 3634 2220 .module_src_\n+00019900: 6772 6f6d 6163 735f 6669 6c65 696f 2623 gromacs_fileio&#\n+00019910: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+00019920: 635f 6772 6f6d 6163 735f 7472 616a 6563 c_gromacs_trajec\n+00019930: 746f 7279 3c2f 7469 746c 653e 0a3c 7061 tory....\n+00019ac0: 0a3c 6720 6964 3d22 6564 6765 3136 3722 ..<\n+00019ae0: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+00019af0: 5f67 726f 6d61 6373 5f66 696c 6569 6f26 _gromacs_fileio&\n+00019b00: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00019b10: 7263 5f67 726f 6d61 6373 5f6d 6f64 756c rc_gromacs_modul\n+00019b20: 6172 7369 6d75 6c61 746f 723c 2f74 6974 arsimulator......mo\n+00019cb0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00019cc0: 5f66 696c 6569 6f26 2334 353b 2667 743b _fileio->\n+00019cd0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00019ce0: 6373 5f61 7070 6c69 6564 5f66 6f72 6365 cs_applied_force\n+00019cf0: 735f 6177 683c 2f74 6974 6c65 3e0a 3c70 s_awh....\n+0001a0c0: 0a3c 6720 6964 3d22 6564 6765 3137 3522 ..<\n+0001a0e0: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+0001a0f0: 5f67 726f 6d61 6373 5f64 6f6d 6465 6326 _gromacs_domdec&\n+0001a100: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+0001a110: 7263 5f67 726f 6d61 6373 5f6d 6472 756e rc_gromacs_mdrun\n+0001a120: 7574 696c 6974 793c 2f74 6974 6c65 3e0a utility.\n+0001a130: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .....modul\n+0001a360: 655f 7372 635f 6772 6f6d 6163 735f 646f e_src_gromacs_do\n+0001a370: 6d64 6563 2623 3435 3b26 6774 3b6d 6f64 mdec->mod\n+0001a380: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0001a390: 6770 755f 7574 696c 733c 2f74 6974 6c65 gpu_utils</title\n+0001a3a0: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+0001a3b0: 6e65 2220 7374 726f 6b65 3d22 2362 6662 ne\" stroke=\"#bfb\n+0001a3c0: 6662 6622 2064 3d22 4d31 3936 342e 3533 fbf\" d=\"M1964.53\n+0001a3d0: 2c2d 3438 302e 3339 4331 3938 322e 322c ,-480.39C1982.2,\n+0001a3e0: 2d34 3838 2e39 3820 3230 3037 2e30 352c -488.98 2007.05,\n+0001a3f0: 2d35 3032 2e36 3120 3230 3235 2e35 362c -502.61 2025.56,\n+0001a400: 2d35 3138 2e39 3620 3230 3531 2e39 312c -518.96 2051.91,\n+0001a410: 2d35 3432 2e32 3320 3230 3534 2e32 392c -542.23 2054.29,\n+0001a420: 2d35 3532 2e34 3320 3230 3733 2e35 362c -552.43 2073.56,\n+0001a430: 2d35 3831 2e38 3320 3230 3938 2e35 392c -581.83 2098.59,\n+0001a440: 2d36 3230 2e30 3220 3230 3931 2e35 362c -620.02 2091.56,\n+0001a450: 2d36 3339 2032 3132 332e 3536 2c2d 3637 -639 2123.56,-67\n+0001a460: 312e 3537 2032 3134 352e 3839 2c2d 3639 1.57 2145.89,-69\n+0001a470: 342e 3320 3231 3637 2e34 342c 2d36 3831 4.3 2167.44,-681\n+0001a480: 2e33 3620 3231 3835 2e35 362c 2d37 3037 .36 2185.56,-707\n+0001a490: 2e35 3720 3231 3939 2e32 372c 2d37 3237 .57 2199.27,-727\n+0001a4a0: 2e34 2032 3231 392e 3638 2c2d 3838 382e .4 2219.68,-888.\n+0001a4b0: 3539 2032 3232 362e 392c 2d39 3438 2e38 59 2226.9,-948.8\n+0001a4c0: 3622 2f3e 0a3c 706f 6c79 676f 6e20 6669 6\"/>.<polygon fi\n+0001a4d0: 6c6c 3d22 2362 6662 6662 6622 2073 7472 ll=\"#bfbfbf\" str\n+0001a4e0: 6f6b 653d 2223 6266 6266 6266 2220 706f oke=\"#bfbfbf\" po\n+0001a4f0: 696e 7473 3d22 3232 3233 2e34 342c 2d39 ints=\"2223.44,-9\n+0001a500: 3439 2e33 3720 3232 3238 2e31 2c2d 3935 49.37 2228.1,-95\n+0001a510: 382e 3838 2032 3233 302e 3339 2c2d 3934 8.88 2230.39,-94\n+0001a520: 382e 3534 2032 3232 332e 3434 2c2d 3934 8.54 2223.44,-94\n+0001a530: 392e 3337 222f 3e0a 3c2f 673e 0a3c 212d 9.37\"/>.</g>.<!-\n+0001a540: 2d20 6d6f 6475 6c65 5f73 7263 5f67 726f - module_src_gro\n+0001a550: 6d61 6373 5f64 6f6d 6465 6326 2334 353b macs_domdec-\n+0001a560: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+0001a570: 726f 6d61 6373 5f68 6172 6477 6172 6520 romacs_hardware \n+0001a580: 2d2d 3e0a 3c67 2069 643d 2265 6467 6531 -->.<g id=\"edge1\n+0001a590: 3738 2220 636c 6173 733d 2265 6467 6522 78\" class=\"edge\"\n+0001a5a0: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n+0001a5b0: 7372 635f 6772 6f6d 6163 735f 646f 6d64 src_gromacs_domd\n+0001a5c0: 6563 2623 3435 3b26 6774 3b6d 6f64 756c ec->modul\n+0001a5d0: 655f 7372 635f 6772 6f6d 6163 735f 6861 e_src_gromacs_ha\n+0001a5e0: 7264 7761 7265 3c2f 7469 746c 653e 0a3c rdware.<\n+0001a5f0: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n+0001a600: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n+0001a610: 2220 643d 224d 3139 3638 2e39 352c 2d34 \" d=\"M1968.95,-4\n+0001a620: 3739 2e30 3143 3139 3930 2e34 382c 2d34 79.01C1990.48,-4\n+0001a630: 3836 2e38 3720 3230 3230 2e37 382c 2d35 86.87 2020.78,-5\n+0001a640: 3030 2e32 2032 3034 322e 3536 2c2d 3531 00.2 2042.56,-51\n+0001a650: 382e 3936 2032 3130 342e 3139 2c2d 3537 8.96 2104.19,-57\n+0001a660: 322e 3034 2032 3038 372e 3233 2c2d 3631 2.04 2087.23,-61\n+0001a670: 322e 3839 2032 3134 332e 3536 2c2d 3637 2.89 2143.56,-67\n+0001a680: 312e 3537 2032 3136 322e 3737 2c2d 3639 1.57 2162.77,-69\n+0001a690: 312e 3539 2032 3137 382e 3031 2c2d 3638 1.59 2178.01,-68\n+0001a6a0: 352e 3320 3231 3934 2e35 362c 2d37 3037 5.3 2194.56,-707\n+0001a6b0: 2e35 3720 3232 3239 2e37 312c 2d37 3534 .57 2229.71,-754\n+0001a6c0: 2e38 3620 3232 3639 2e31 2c2d 3930 302e .86 2269.1,-900.\n+0001a6d0: 3839 2032 3237 382e 3536 2c2d 3935 392e 89 2278.56,-959.\n+0001a6e0: 3035 2032 3238 312e 3434 2c2d 3937 362e 05 2281.44,-976.\n+0001a6f0: 3739 2032 3237 382e 3136 2c2d 3939 362e 79 2278.16,-996.\n+0001a700: 3933 2032 3237 342e 3435 2c2d 3130 3131 93 2274.45,-1011\n+0001a710: 2e39 3222 2f3e 0a3c 706f 6c79 676f 6e20 .92\"/>.....m\n+0001a800: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001a810: 735f 646f 6d64 6563 2623 3435 3b26 6774 s_domdec->\n+0001a820: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+0001a830: 6163 735f 6c69 7374 6564 5f66 6f72 6365 acs_listed_force\n+0001a840: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s......modu\n+0001a9e0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f64 le_src_gromacs_d\n+0001a9f0: 6f6d 6465 6326 2334 353b 2667 743b 6d6f omdec->mo\n+0001aa00: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0001aa10: 5f6e 626e 786d 3c2f 7469 746c 653e 0a3c _nbnxm.<\n+0001aa20: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n+0001aa30: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n+0001aa40: 2220 7374 726f 6b65 2d64 6173 6861 7272 \" stroke-dasharr\n+0001aa50: 6179 3d22 352c 3222 2064 3d22 4d31 3937 ay=\"5,2\" d=\"M197\n+0001aa60: 372e 3338 2c2d 3436 352e 3433 4332 3131 7.38,-465.43C211\n+0001aa70: 322e 3231 2c2d 3435 332e 3533 2032 3539 2.21,-453.53 259\n+0001aa80: 312e 3536 2c2d 3430 382e 3238 2032 3539 1.56,-408.28 259\n+0001aa90: 312e 3536 2c2d 3334 342e 3739 2032 3539 1.56,-344.79 259\n+0001aaa0: 312e 3536 2c2d 3334 342e 3739 2032 3539 1.56,-344.79 259\n+0001aab0: 312e 3536 2c2d 3334 342e 3739 2032 3539 1.56,-344.79 259\n+0001aac0: 312e 3536 2c2d 3237 392e 3932 2032 3539 1.56,-279.92 259\n+0001aad0: 312e 3536 2c2d 3232 302e 3836 2032 3539 1.56,-220.86 259\n+0001aae0: 302e 3034 2c2d 3135 312e 3320 3235 3932 0.04,-151.3 2592\n+0001aaf0: 2e34 312c 2d31 3136 2e31 3322 2f3e 0a3c .41,-116.13\"/>.<\n+0001ab00: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+0001ab10: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+0001ab20: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+0001ab30: 3235 3935 2e39 312c 2d31 3136 2e32 3520 2595.91,-116.25 \n+0001ab40: 3235 3933 2e33 332c 2d31 3035 2e39 3720 2593.33,-105.97 \n+0001ab50: 3235 3838 2e39 342c 2d31 3135 2e36 3220 2588.94,-115.62 \n+0001ab60: 3235 3935 2e39 312c 2d31 3136 2e32 3522 2595.91,-116.25\"\n+0001ab70: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />....module_src_grom\n+0001abf0: 6163 735f 646f 6d64 6563 2623 3435 3b26 acs_domdec-&\n+0001ac00: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+0001ac10: 6f6d 6163 735f 6d64 7275 6e3c 2f74 6974 omacs_mdrun......module_src_gr\n+0001ad90: 6f6d 6163 735f 646f 6d64 6563 2623 3435 omacs_domdec-\n+0001ada0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0001adb0: 6772 6f6d 6163 735f 696d 643c 2f74 6974 gromacs_imd......module_src_grom\n+0001afc0: 6163 735f 646f 6d64 6563 2623 3435 3b26 acs_domdec-&\n+0001afd0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+0001afe0: 6f6d 6163 735f 676d 786c 6962 3c2f 7469 omacs_gmxlib..\n+0001b100: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....\n+0001b170: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0001b180: 6373 5f64 6f6d 6465 6326 2334 353b 2667 cs_domdec-&g\n+0001b190: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+0001b1a0: 6d61 6373 5f63 6f6d 7061 743c 2f74 6974 macs_compat</tit\n+0001b1b0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n+0001b1c0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n+0001b1d0: 3832 6663 6322 2064 3d22 4d31 3935 382e 82fcc\" d=\"M1958.\n+0001b1e0: 3431 2c2d 3435 372e 3234 4332 3030 322e 41,-457.24C2002.\n+0001b1f0: 3635 2c2d 3432 352e 3235 2032 3132 392e 65,-425.25 2129.\n+0001b200: 392c 2d33 3239 2e39 3220 3232 3136 2e35 9,-329.92 2216.5\n+0001b210: 362c 2d32 3331 2e34 3820 3232 3331 2e34 6,-231.48 2231.4\n+0001b220: 322c 2d32 3134 2e36 2032 3234 352e 332c 2,-214.6 2245.3,\n+0001b230: 2d31 3933 2e30 3320 3232 3534 2e36 352c -193.03 2254.65,\n+0001b240: 2d31 3737 2e33 3122 2f3e 0a3c 706f 6c79 -177.31\"/>.<poly\n+0001b250: 676f 6e20 6669 6c6c 3d22 2332 3832 6663 gon fill=\"#282fc\n+0001b260: 6322 2073 7472 6f6b 653d 2223 3238 3266 c\" stroke=\"#282f\n+0001b270: 6363 2220 706f 696e 7473 3d22 3232 3537 cc\" points=\"2257\n+0001b280: 2e38 352c 2d31 3738 2e37 3720 3232 3539 .85,-178.77 2259\n+0001b290: 2e38 362c 2d31 3638 2e33 3620 3232 3531 .86,-168.36 2251\n+0001b2a0: 2e38 2c2d 3137 352e 3235 2032 3235 372e .8,-175.25 2257.\n+0001b2b0: 3835 2c2d 3137 382e 3737 222f 3e0a 3c2f 85,-178.77\"/>.</\n+0001b2c0: 673e 0a3c 212d 2d20 6d6f 6475 6c65 5f73 g>.<!-- module_s\n+0001b2d0: 7263 5f67 726f 6d61 6373 5f64 6f6d 6465 rc_gromacs_domde\n+0001b2e0: 6326 2334 353b 2667 743b 6d6f 6475 6c65 c->module\n+0001b2f0: 5f73 7263 5f67 726f 6d61 6373 5f6d 6474 _src_gromacs_mdt\n+0001b300: 7970 6573 202d 2d3e 0a3c 6720 6964 3d22 ypes -->.<g id=\"\n+0001b310: 6564 6765 3137 3022 2063 6c61 7373 3d22 edge170\" class=\"\n+0001b320: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n+0001b330: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0001b340: 5f64 6f6d 6465 6326 2334 353b 2667 743b _domdec->\n+0001b350: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0001b360: 6373 5f6d 6474 7970 6573 3c2f 7469 746c cs_mdtypes</titl\n+0001b370: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n+0001b380: 6f6e 6522 2073 7472 6f6b 653d 2223 6266 one\" stroke=\"#bf\n+0001b390: 6266 6266 2220 643d 224d 3139 3533 2e33 bfbf\" d=\"M1953.3\n+0001b3a0: 322c 2d34 3832 2e35 3943 3139 3631 2e38 2,-482.59C1961.8\n+0001b3b0: 372c 2d34 3937 2e37 3420 3139 3732 2e36 7,-497.74 1972.6\n+0001b3c0: 382c 2d35 3234 2e33 3520 3139 3834 2e35 8,-524.35 1984.5\n+0001b3d0: 362c 2d35 3435 2e38 3320 3139 3839 2e38 6,-545.83 1989.8\n+0001b3e0: 322c 2d35 3535 2e33 3420 3230 3931 2e33 2,-555.34 2091.3\n+0001b3f0: 362c 2d36 3937 2e31 3820 3230 3934 2e35 6,-697.18 2094.5\n+0001b400: 362c 2d37 3037 2e35 3720 3230 3938 2e30 6,-707.57 2098.0\n+0001b410: 372c 2d37 3138 2e39 3820 3230 3938 2e39 7,-718.98 2098.9\n+0001b420: 332c 2d37 3233 2e33 3320 3230 3934 2e35 3,-723.33 2094.5\n+0001b430: 362c 2d37 3334 2e34 3420 3230 3636 2e34 6,-734.44 2066.4\n+0001b440: 382c 2d38 3035 2e38 3720 3139 3933 2e37 8,-805.87 1993.7\n+0001b450: 382c 2d38 3635 2e33 3920 3139 3532 2e36 8,-865.39 1952.6\n+0001b460: 312c 2d38 3932 2e36 3422 2f3e 0a3c 706f 1,-892.64\"/>.<po\n+0001b470: 6c79 676f 6e20 6669 6c6c 3d22 2362 6662 lygon fill=\"#bfb\n+0001b480: 6662 6622 2073 7472 6f6b 653d 2223 6266 fbf\" stroke=\"#bf\n+0001b490: 6266 6266 2220 706f 696e 7473 3d22 3139 bfbf\" points=\"19\n+0001b4a0: 3530 2e36 312c 2d38 3839 2e37 3720 3139 50.61,-889.77 19\n+0001b4b0: 3434 2e30 392c 2d38 3938 2e31 3120 3139 44.09,-898.11 19\n+0001b4c0: 3534 2e33 392c 2d38 3935 2e36 3620 3139 54.39,-895.66 19\n+0001b4d0: 3530 2e36 312c 2d38 3839 2e37 3722 2f3e 50.61,-889.77\"/>\n+0001b4e0: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c .</g>.<!-- modul\n+0001b4f0: 655f 7372 635f 6772 6f6d 6163 735f 646f e_src_gromacs_do\n+0001b500: 6d64 6563 2623 3435 3b26 6774 3b6d 6f64 mdec->mod\n+0001b510: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0001b520: 6d64 6c69 6220 2d2d 3e0a 3c67 2069 643d mdlib -->.<g id=\n+0001b530: 2265 6467 6531 3734 2220 636c 6173 733d \"edge174\" class=\n+0001b540: 2265 6467 6522 3e0a 3c74 6974 6c65 3e6d \"edge\">.<title>m\n+0001b550: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001b560: 735f 646f 6d64 6563 2623 3435 3b26 6774 s_domdec->\n+0001b570: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+0001b580: 6163 735f 6d64 6c69 623c 2f74 6974 6c65 acs_mdlib</title\n+0001b590: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+0001b5a0: 6e65 2220 7374 726f 6b65 3d22 2362 6662 ne\" stroke=\"#bfb\n+0001b5b0: 6662 6622 2064 3d22 4d31 3930 372e 3134 fbf\" d=\"M1907.14\n+0001b5c0: 2c2d 3436 362e 3634 4331 3836 392e 3935 ,-466.64C1869.95\n+0001b5d0: 2c2d 3436 322e 3937 2031 3831 322e 3334 ,-462.97 1812.34\n+0001b5e0: 2c2d 3435 322e 3132 2031 3737 352e 3536 ,-452.12 1775.56\n+0001b5f0: 2c2d 3432 302e 3039 2031 3731 392e 3134 ,-420.09 1719.14\n+0001b600: 2c2d 3337 302e 3937 2031 3736 312e 3739 ,-370.97 1761.79\n+0001b610: 2c2d 3331 352e 3636 2031 3730 342e 3536 ,-315.66 1704.56\n+0001b620: 2c2d 3236 372e 3438 2031 3636 362e 3835 ,-267.48 1666.85\n+0001b630: 2c2d 3233 352e 3733 2031 3631 302e 3232 ,-235.73 1610.22\n+0001b640: 2c2d 3232 342e 3634 2031 3537 322e 3732 ,-224.64 1572.72\n+0001b650: 2c2d 3232 302e 3834 222f 3e0a 3c70 6f6c ,-220.84\"/>.<pol\n+0001b660: 7967 6f6e 2066 696c 6c3d 2223 6266 6266 ygon fill=\"#bfbf\n+0001b670: 6266 2220 7374 726f 6b65 3d22 2362 6662 bf\" stroke=\"#bfb\n+0001b680: 6662 6622 2070 6f69 6e74 733d 2231 3537 fbf\" points=\"157\n+0001b690: 322e 3935 2c2d 3231 372e 3335 2031 3536 2.95,-217.35 156\n+0001b6a0: 322e 3638 2c2d 3231 392e 3936 2031 3537 2.68,-219.96 157\n+0001b6b0: 322e 3333 2c2d 3232 342e 3332 2031 3537 2.33,-224.32 157\n+0001b6c0: 322e 3935 2c2d 3231 372e 3335 222f 3e0a 2.95,-217.35\"/>.\n+0001b6d0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 </g>.<!-- module\n+0001b6e0: 5f73 7263 5f67 726f 6d61 6373 5f64 6f6d _src_gromacs_dom\n+0001b6f0: 6465 6326 2334 353b 2667 743b 6d6f 6475 dec->modu\n+0001b700: 6c65 5f73 7263 5f67 726f 6d61 6373 5f66 le_src_gromacs_f\n+0001b710: 696c 6569 6f20 2d2d 3e0a 3c67 2069 643d ileio -->.<g id=\n+0001b720: 2265 6467 6531 3639 2220 636c 6173 733d \"edge169\" class=\n+0001b730: 2265 6467 6522 3e0a 3c74 6974 6c65 3e6d \"edge\">.<title>m\n+0001b740: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001b750: 735f 646f 6d64 6563 2623 3435 3b26 6774 s_domdec->\n+0001b760: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+0001b770: 6163 735f 6669 6c65 696f 3c2f 7469 746c acs_fileio</titl\n+0001b780: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n+0001b790: 6f6e 6522 2073 7472 6f6b 653d 2223 6266 one\" stroke=\"#bf\n+0001b7a0: 6266 6266 2220 643d 224d 3139 3132 2e30 bfbf\" d=\"M1912.0\n+0001b7b0: 372c 2d34 3736 2e38 3243 3137 3735 2e31 7,-476.82C1775.1\n+0001b7c0: 312c 2d35 3035 2e30 3920 3132 3137 2e31 1,-505.09 1217.1\n+0001b7d0: 342c 2d36 3230 2e32 3720 3130 3732 2e37 4,-620.27 1072.7\n+0001b7e0: 392c 2d36 3530 2e30 3722 2f3e 0a3c 706f 9,-650.07\"/>.<po\n+0001b7f0: 6c79 676f 6e20 6669 6c6c 3d22 2362 6662 lygon fill=\"#bfb\n+0001b800: 6662 6622 2073 7472 6f6b 653d 2223 6266 fbf\" stroke=\"#bf\n+0001b810: 6266 6266 2220 706f 696e 7473 3d22 3130 bfbf\" points=\"10\n+0001b820: 3731 2e38 332c 2d36 3436 2e36 3920 3130 71.83,-646.69 10\n+0001b830: 3632 2e37 342c 2d36 3532 2e31 3420 3130 62.74,-652.14 10\n+0001b840: 3733 2e32 342c 2d36 3533 2e35 3520 3130 73.24,-653.55 10\n+0001b850: 3731 2e38 332c 2d36 3436 2e36 3922 2f3e 71.83,-646.69\"/>\n+0001b860: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c .</g>.<!-- modul\n+0001b870: 655f 7372 635f 6772 6f6d 6163 735f 646f e_src_gromacs_do\n+0001b880: 6d64 6563 2623 3435 3b26 6774 3b6d 6f64 mdec->mod\n+0001b890: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0001b8a0: 6577 616c 6420 2d2d 3e0a 3c67 2069 643d ewald -->.<g id=\n+0001b8b0: 2265 6467 6531 3732 2220 636c 6173 733d \"edge172\" class=\n+0001b8c0: 2265 6467 6522 3e0a 3c74 6974 6c65 3e6d \"edge\">.<title>m\n+0001b8d0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001b8e0: 735f 646f 6d64 6563 2623 3435 3b26 6774 s_domdec->\n+0001b8f0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+0001b900: 6163 735f 6577 616c 643c 2f74 6974 6c65 acs_ewald</title\n+0001b910: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+0001b920: 6e65 2220 7374 726f 6b65 3d22 7265 6422 ne\" stroke=\"red\"\n+0001b930: 2064 3d22 4d31 3930 392e 3038 2c2d 3436 d=\"M1909.08,-46\n+0001b940: 342e 3435 4331 3835 372e 3435 2c2d 3435 4.45C1857.45,-45\n+0001b950: 372e 3034 2031 3736 322e 3234 2c2d 3434 7.04 1762.24,-44\n+0001b960: 302e 3235 2031 3733 352e 3536 2c2d 3432 0.25 1735.56,-42\n+0001b970: 302e 3039 2031 3639 382e 3935 2c2d 3339 0.09 1698.95,-39\n+0001b980: 322e 3434 2031 3731 362e 3733 2c2d 3336 2.44 1716.73,-36\n+0001b990: 332e 3036 2031 3638 342e 3536 2c2d 3333 3.06 1684.56,-33\n+0001b9a0: 302e 3335 2031 3637 302e 3833 2c2d 3331 0.35 1670.83,-31\n+0001b9b0: 362e 3339 2031 3635 322e 3236 2c2d 3330 6.39 1652.26,-30\n+0001b9c0: 342e 3938 2031 3633 372e 3135 2c2d 3239 4.98 1637.15,-29\n+0001b9d0: 362e 3735 222f 3e0a 3c70 6f6c 7967 6f6e 6.75\"/>.<polygon\n+0001b9e0: 2066 696c 6c3d 2272 6564 2220 7374 726f fill=\"red\" stro\n+0001b9f0: 6b65 3d22 7265 6422 2070 6f69 6e74 733d ke=\"red\" points=\n+0001ba00: 2231 3633 382e 3734 2c2d 3239 332e 3633 \"1638.74,-293.63\n+0001ba10: 2031 3632 382e 3236 2c2d 3239 322e 3034 1628.26,-292.04\n+0001ba20: 2031 3633 352e 3436 2c2d 3239 392e 3832 1635.46,-299.82\n+0001ba30: 2031 3633 382e 3734 2c2d 3239 332e 3633 1638.74,-293.63\n+0001ba40: 222f 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f \"/>.</g>.<!-- mo\n+0001ba50: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0001ba60: 5f65 6e65 7267 7961 6e61 6c79 7369 7320 _energyanalysis \n+0001ba70: 2d2d 3e0a 3c67 2069 643d 226e 6f64 6533 -->.<g id=\"node3\n+0001ba80: 3422 2063 6c61 7373 3d22 6e6f 6465 223e 4\" class=\"node\">\n+0001ba90: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n+0001baa0: 7263 5f67 726f 6d61 6373 5f65 6e65 7267 rc_gromacs_energ\n+0001bab0: 7961 6e61 6c79 7369 733c 2f74 6974 6c65 yanalysis</title\n+0001bac0: 3e0a 3c67 2069 643d 2261 5f6e 6f64 6533 >.<g id=\"a_node3\n+0001bad0: 3422 3e3c 6120 786c 696e 6b3a 6872 6566 4\"><a xlink:href\n+0001bae0: 3d22 6772 6f75 705f 5f6d 6f64 756c 655f =\"group__module_\n+0001baf0: 5f65 6e65 7267 7961 6e61 6c79 7369 732e _energyanalysis.\n+0001bb00: 7868 746d 6c22 2074 6172 6765 743d 225f xhtml\" target=\"_\n+0001bb10: 746f 7022 2078 6c69 6e6b 3a74 6974 6c65 top\" xlink:title\n+0001bb20: 3d22 656e 6572 6779 616e 616c 7973 6973 =\"energyanalysis\n+0001bb30: 223e 0a3c 656c 6c69 7073 6520 6669 6c6c \">.<ellipse fill\n+0001bb40: 3d22 2366 6663 6363 6322 2073 7472 6f6b =\"#ffcccc\" strok\n+0001bb50: 653d 2262 6c61 636b 2220 6378 3d22 3131 e=\"black\" cx=\"11\n+0001bb60: 3932 2e35 3622 2063 793d 222d 3738 332e 92.56\" cy=\"-783.\n+0001bb70: 3838 2220 7278 3d22 3536 2e36 3422 2072 88\" rx=\"56.64\" r\n+0001bb80: 793d 2231 332e 3337 222f 3e0a 3c74 6578 y=\"13.37\"/>.<tex\n+0001bb90: 7420 7465 7874 2d61 6e63 686f 723d 226d t text-anchor=\"m\n+0001bba0: 6964 646c 6522 2078 3d22 3131 3932 2e35 iddle\" x=\"1192.5\n+0001bbb0: 3622 2079 3d22 2d37 3831 2e33 3822 2066 6\" y=\"-781.38\" f\n+0001bbc0: 6f6e 742d 6661 6d69 6c79 3d22 4672 6565 ont-family=\"Free\n+0001bbd0: 5361 6e73 2220 666f 6e74 2d73 697a 653d Sans\" font-size=\n+0001bbe0: 2231 302e 3030 223e 656e 6572 6779 616e \"10.00\">energyan\n+0001bbf0: 616c 7973 6973 3c2f 7465 7874 3e0a 3c2f alysis</text>.</\n+0001bc00: 613e 0a3c 2f67 3e0a 3c2f 673e 0a3c 212d a>.</g>.</g>.<!-\n+0001bc10: 2d20 6d6f 6475 6c65 5f73 7263 5f67 726f - module_src_gro\n+0001bc20: 6d61 6373 5f65 6e65 7267 7961 6e61 6c79 macs_energyanaly\n+0001bc30: 7369 7326 2334 353b 2667 743b 6d6f 6475 sis->modu\n+0001bc40: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+0001bc50: 6d78 616e 6120 2d2d 3e0a 3c67 2069 643d mxana -->.<g id=\n+0001bc60: 2265 6467 6531 3835 2220 636c 6173 733d \"edge185\" class=\n 0001bc70: 2265 6467 6522 3e0a 3c74 6974 6c65 3e6d \"edge\">.<title>m\n 0001bc80: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001bc90: 735f 676d 7870 7265 7072 6f63 6573 7326 s_gmxpreprocess&\n-0001bca0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-0001bcb0: 7263 5f67 726f 6d61 6373 5f61 7070 6c69 rc_gromacs_appli\n-0001bcc0: 6564 5f66 6f72 6365 735f 6177 683c 2f74 ed_forces_awh</t\n-0001bcd0: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n-0001bce0: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n-0001bcf0: 2332 3832 6663 6322 2073 7472 6f6b 652d #282fcc\" stroke-\n-0001bd00: 6461 7368 6172 7261 793d 2235 2c32 2220 dasharray=\"5,2\" \n-0001bd10: 643d 224d 3130 3537 2e37 342c 2d39 3538 d=\"M1057.74,-958\n-0001bd20: 2e39 3343 3130 3535 2e31 332c 2d39 3135 .93C1055.13,-915\n-0001bd30: 2e32 3620 3130 3438 2e31 322c 2d37 3636 .26 1048.12,-766\n-0001bd40: 2e30 3320 3130 3635 2e35 362c 2d36 3434 .03 1065.56,-644\n-0001bd50: 2e37 2031 3037 372e 3235 2c2d 3536 332e .7 1077.25,-563.\n-0001bd60: 3335 2031 3131 302e 3134 2c2d 3437 302e 35 1110.14,-470.\n-0001bd70: 3838 2031 3132 352e 3931 2c2d 3432 392e 88 1125.91,-429.\n-0001bd80: 3538 222f 3e0a 3c70 6f6c 7967 6f6e 2066 58\"/>.<polygon f\n-0001bd90: 696c 6c3d 2223 3238 3266 6363 2220 7374 ill=\"#282fcc\" st\n-0001bda0: 726f 6b65 3d22 2332 3832 6663 6322 2070 roke=\"#282fcc\" p\n-0001bdb0: 6f69 6e74 733d 2231 3132 392e 3139 2c2d oints=\"1129.19,-\n-0001bdc0: 3433 302e 3831 2031 3132 392e 3533 2c2d 430.81 1129.53,-\n-0001bdd0: 3432 302e 3232 2031 3132 322e 3636 2c2d 420.22 1122.66,-\n-0001bde0: 3432 382e 3239 2031 3132 392e 3139 2c2d 428.29 1129.19,-\n-0001bdf0: 3433 302e 3831 222f 3e0a 3c2f 673e 0a3c 430.81\"/>.</g>.<\n-0001be00: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-0001be10: 726f 6d61 6373 5f6d 646c 6962 2623 3435 romacs_mdlib-\n-0001be20: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-0001be30: 6772 6f6d 6163 735f 6770 755f 7574 696c gromacs_gpu_util\n-0001be40: 7320 2d2d 3e0a 3c67 2069 643d 2265 6467 s -->.<g id=\"edg\n-0001be50: 6531 3735 2220 636c 6173 733d 2265 6467 e175\" class=\"edg\n-0001be60: 6522 3e0a 3c74 6974 6c65 3e6d 6f64 756c e\">.<title>modul\n-0001be70: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n-0001be80: 6c69 6226 2334 353b 2667 743b 6d6f 6475 lib->modu\n-0001be90: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n-0001bea0: 7075 5f75 7469 6c73 3c2f 7469 746c 653e pu_utils\n-0001beb0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ...\n-0001bfb0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ..<\n-0001c000: 6720 6964 3d22 6564 6765 3138 3622 2063 g id=\"edge186\" c\n-0001c010: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-0001c030: 726f 6d61 6373 5f6d 646c 6962 2623 3435 romacs_mdlib-\n-0001c040: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-0001c050: 6772 6f6d 6163 735f 6d64 7275 6e75 7469 gromacs_mdrunuti\n-0001c060: 6c69 7479 3c2f 7469 746c 653e 0a3c 7061 lity....\n-0001c1d0: 0a3c 6720 6964 3d22 6564 6765 3138 3022 ..<\n-0001c1f0: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-0001c200: 5f67 726f 6d61 6373 5f6d 646c 6962 2623 _gromacs_mdlib&#\n-0001c210: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-0001c220: 635f 6772 6f6d 6163 735f 7261 6e64 6f6d c_gromacs_random\n-0001c230: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......module_src_gr\n-0001c3d0: 6f6d 6163 735f 6d64 6c69 6226 2334 353b omacs_mdlib-\n-0001c3e0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0001c3f0: 726f 6d61 6373 5f74 6162 6c65 733c 2f74 romacs_tables....\n-0001c600: 0a3c 6720 6964 3d22 6564 6765 3139 3122 ..<\n-0001c620: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-0001c630: 5f67 726f 6d61 6373 5f6d 646c 6962 2623 _gromacs_mdlib&#\n-0001c640: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-0001c650: 635f 6772 6f6d 6163 735f 6861 7264 7761 c_gromacs_hardwa\n-0001c660: 7265 3c2f 7469 746c 653e 0a3c 7061 7468 re.\n-0001c730: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....module\n-0001c820: 5f73 7263 5f67 726f 6d61 6373 5f6d 646c _src_gromacs_mdl\n-0001c830: 6962 2623 3435 3b26 6774 3b6d 6f64 756c ib->modul\n-0001c840: 655f 7372 635f 6772 6f6d 6163 735f 6c69 e_src_gromacs_li\n-0001c850: 7374 6564 5f66 6f72 6365 733c 2f74 6974 sted_forces</tit\n-0001c860: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-0001c870: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n-0001c880: 3832 6663 6322 2073 7472 6f6b 652d 6461 82fcc\" stroke-da\n-0001c890: 7368 6172 7261 793d 2235 2c32 2220 643d sharray=\"5,2\" d=\n-0001c8a0: 224d 3135 3334 2e39 382c 2d36 3537 2e36 \"M1534.98,-657.6\n-0001c8b0: 3743 3136 3032 2e31 362c 2d36 3537 2e38 7C1602.16,-657.8\n-0001c8c0: 3720 3137 3734 2e32 392c 2d36 3533 2e32 7 1774.29,-653.2\n-0001c8d0: 3520 3139 3039 2e35 362c 2d36 3038 2e37 5 1909.56,-608.7\n-0001c8e0: 2031 3936 332e 3035 2c2d 3539 312e 3039 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3933 2032 3130 352e 3636 2c2d 3336 3.93 2105.66,-36\n-0001c9e0: 372e 3435 222f 3e0a 3c2f 673e 0a3c 212d 7.45\"/>.</g>.<!-\n-0001c9f0: 2d20 6d6f 6475 6c65 5f73 7263 5f67 726f - module_src_gro\n-0001ca00: 6d61 6373 5f6d 646c 6962 2623 3435 3b26 macs_mdlib-&\n-0001ca10: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001ca20: 6f6d 6163 735f 6e62 6e78 6d20 2d2d 3e0a omacs_nbnxm -->.\n-0001ca30: 3c67 2069 643d 2265 6467 6531 3834 2220 <g id=\"edge184\" \n-0001ca40: 636c 6173 733d 2265 6467 6522 3e0a 3c74 class=\"edge\">.<t\n-0001ca50: 6974 6c65 3e6d 6f64 756c 655f 7372 635f itle>module_src_\n-0001ca60: 6772 6f6d 6163 735f 6d64 6c69 6226 2334 gromacs_mdlib\n-0001ca70: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001ca80: 5f67 726f 6d61 6373 5f6e 626e 786d 3c2f _gromacs_nbnxm</\n-0001ca90: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-0001caa0: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-0001cab0: 2272 6564 2220 643d 224d 3135 3330 2e32 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4.02\"/>.</g>.<!-\n-0001cba0: 2d20 6d6f 6475 6c65 5f73 7263 5f67 726f - module_src_gro\n-0001cbb0: 6d61 6373 5f6d 646c 6962 2623 3435 3b26 macs_mdlib-&\n-0001cbc0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001cbd0: 6f6d 6163 735f 696d 6420 2d2d 3e0a 3c67 omacs_imd -->.<g\n-0001cbe0: 2069 643d 2265 6467 6531 3930 2220 636c id=\"edge190\" cl\n-0001cbf0: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.<tit\n-0001cc00: 6c65 3e6d 6f64 756c 655f 7372 635f 6772 le>module_src_gr\n-0001cc10: 6f6d 6163 735f 6d64 6c69 6226 2334 353b omacs_mdlib-\n-0001cc20: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0001cc30: 726f 6d61 6373 5f69 6d64 3c2f 7469 746c romacs_imd</titl\n-0001cc40: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n-0001cc50: 6f6e 6522 2073 7472 6f6b 653d 2223 3238 one\" stroke=\"#28\n-0001cc60: 3266 6363 2220 7374 726f 6b65 2d64 6173 2fcc\" stroke-das\n-0001cc70: 6861 7272 6179 3d22 352c 3222 2064 3d22 harray=\"5,2\" d=\"\n-0001cc80: 4d31 3438 322e 3031 2c2d 3635 312e 3236 M1482.01,-651.26\n-0001cc90: 4331 3434 312e 332c 2d36 3338 2e38 3820 C1441.3,-638.88 \n-0001cca0: 3133 3632 2e36 382c 2d36 3036 2e31 3720 1362.68,-606.17 \n-0001ccb0: 3133 3336 2e35 362c 2d35 3435 2e38 3320 1336.56,-545.83 \n-0001ccc0: 3133 3139 2e31 332c 2d35 3035 2e35 3720 1319.13,-505.57 \n-0001ccd0: 3133 3431 2e38 362c 2d34 3534 2e35 3420 1341.86,-454.54 \n-0001cce0: 3133 3630 2e33 372c 2d34 3237 2e31 3522 1360.37,-427.15\"\n-0001ccf0: 2f3e 0a3c 706f 6c79 676f 6e20 6669 6c6c />.<polygon fill\n-0001cd00: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n-0001cd10: 653d 2223 3238 3266 6363 2220 706f 696e e=\"#282fcc\" poin\n-0001cd20: 7473 3d22 3133 3633 2e33 382c 2d34 3238 ts=\"1363.38,-428\n-0001cd30: 2e39 3720 3133 3636 2e34 322c 2d34 3138 .97 1366.42,-418\n-0001cd40: 2e38 3220 3133 3537 2e37 312c 2d34 3234 .82 1357.71,-424\n-0001cd50: 2e38 3520 3133 3633 2e33 382c 2d34 3238 .85 1363.38,-428\n-0001cd60: 2e39 3722 2f3e 0a3c 2f67 3e0a 3c21 2d2d .97\"/>.</g>.<!--\n-0001cd70: 206d 6f64 756c 655f 7372 635f 6772 6f6d module_src_grom\n-0001cd80: 6163 735f 6d64 6c69 6226 2334 353b 2667 acs_mdlib-&g\n-0001cd90: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-0001cda0: 6d61 6373 5f67 6d78 6c69 6220 2d2d 3e0a macs_gmxlib -->.\n-0001cdb0: 3c67 2069 643d 2265 6467 6531 3737 2220 <g id=\"edge177\" \n-0001cdc0: 636c 6173 733d 2265 6467 6522 3e0a 3c74 class=\"edge\">.<t\n-0001cdd0: 6974 6c65 3e6d 6f64 756c 655f 7372 635f itle>module_src_\n-0001cde0: 6772 6f6d 6163 735f 6d64 6c69 6226 2334 gromacs_mdlib\n-0001cdf0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001ce00: 5f67 726f 6d61 6373 5f67 6d78 6c69 623c _gromacs_gmxlib<\n-0001ce10: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n-0001ce20: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n-0001ce30: 3d22 2362 6662 6662 6622 2064 3d22 4d31 =\"#bfbfbf\" d=\"M1\n-0001ce40: 3439 312e 332c 2d36 3436 2e35 3243 3134 491.3,-646.52C14\n-0001ce50: 3832 2e34 392c 2d36 3337 2e30 3520 3134 82.49,-637.05 14\n-0001ce60: 3732 2e37 312c 2d36 3232 2e35 3720 3134 72.71,-622.57 14\n-0001ce70: 3636 2e35 362c 2d36 3038 2e37 2031 3435 66.56,-608.7 145\n-0001ce80: 382e 3834 2c2d 3539 312e 3239 2031 3338 8.84,-591.29 138\n-0001ce90: 372e 3836 2c2d 3332 322e 3734 2031 3337 7.86,-322.74 137\n-0001cea0: 322e 3037 2c2d 3234 312e 3922 2f3e 0a3c 2.07,-241.9\"/>.<\n-0001ceb0: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n-0001cec0: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n-0001ced0: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n-0001cee0: 3133 3735 2e34 372c 2d32 3430 2e39 3920 1375.47,-240.99 \n-0001cef0: 3133 3730 2e32 322c 2d32 3331 2e37 3820 1370.22,-231.78 \n-0001cf00: 3133 3638 2e35 382c 2d32 3432 2e32 3520 1368.58,-242.25 \n-0001cf10: 3133 3735 2e34 372c 2d32 3430 2e39 3922 1375.47,-240.99\"\n-0001cf20: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />.</g>.<!-- mod\n-0001cf30: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0001cf40: 6d64 6c69 6226 2334 353b 2667 743b 6d6f mdlib->mo\n-0001cf50: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0001cf60: 5f63 6f6d 7061 7420 2d2d 3e0a 3c67 2069 _compat -->.<g i\n-0001cf70: 643d 2265 6467 6531 3833 2220 636c 6173 d=\"edge183\" clas\n-0001cf80: 733d 2265 6467 6522 3e0a 3c74 6974 6c65 s=\"edge\">.<title\n-0001cf90: 3e6d 6f64 756c 655f 7372 635f 6772 6f6d >module_src_grom\n-0001cfa0: 6163 735f 6d64 6c69 6226 2334 353b 2667 acs_mdlib-&g\n-0001cfb0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-0001cfc0: 6d61 6373 5f63 6f6d 7061 743c 2f74 6974 macs_compat</tit\n-0001cfd0: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-0001cfe0: 6e6f 6e65 2220 7374 726f 6b65 3d22 2332 none\" stroke=\"#2\n-0001cff0: 3832 6663 6322 2064 3d22 4d31 3533 342e 82fcc\" d=\"M1534.\n-0001d000: 3834 2c2d 3635 362e 3837 4331 3635 332e 84,-656.87C1653.\n-0001d010: 3838 2c2d 3635 352e 3520 3231 3134 2e35 88,-655.5 2114.5\n-0001d020: 322c 2d36 3437 2e37 3320 3232 3533 2e35 2,-647.73 2253.5\n-0001d030: 362c 2d36 3038 2e37 2032 3431 302e 3539 6,-608.7 2410.59\n-0001d040: 2c2d 3536 342e 3632 2032 3530 382e 3536 ,-564.62 2508.56\n-0001d050: 2c2d 3530 372e 3839 2032 3530 382e 3536 ,-507.89 2508.56\n-0001d060: 2c2d 3334 342e 3739 2032 3530 382e 3536 ,-344.79 2508.56\n-0001d070: 2c2d 3334 342e 3739 2032 3530 382e 3536 ,-344.79 2508.56\n-0001d080: 2c2d 3334 342e 3739 2032 3530 382e 3536 ,-344.79 2508.56\n-0001d090: 2c2d 3135 342e 3138 2032 3530 382e 3536 ,-154.18 2508.56\n-0001d0a0: 2c2d 3131 382e 3335 2032 3530 302e 3239 ,-118.35 2500.29\n-0001d0b0: 2c2d 3737 2e34 3220 3234 3934 2e33 382c ,-77.42 2494.38,\n-0001d0c0: 2d35 322e 3738 222f 3e0a 3c70 6f6c 7967 -52.78\"/>.<polyg\n-0001d0d0: 6f6e 2066 696c 6c3d 2223 3238 3266 6363 on fill=\"#282fcc\n-0001d0e0: 2220 7374 726f 6b65 3d22 2332 3832 6663 \" stroke=\"#282fc\n-0001d0f0: 6322 2070 6f69 6e74 733d 2232 3439 372e c\" points=\"2497.\n-0001d100: 3736 2c2d 3531 2e38 3420 3234 3931 2e39 76,-51.84 2491.9\n-0001d110: 352c 2d34 322e 3937 2032 3439 302e 3936 5,-42.97 2490.96\n-0001d120: 2c2d 3533 2e35 3220 3234 3937 2e37 362c ,-53.52 2497.76,\n-0001d130: 2d35 312e 3834 222f 3e0a 3c2f 673e 0a3c -51.84\"/>.</g>.<\n-0001d140: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-0001d150: 726f 6d61 6373 5f6d 646c 6962 2623 3435 romacs_mdlib-\n-0001d160: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-0001d170: 6772 6f6d 6163 735f 6573 7365 6e74 6961 gromacs_essentia\n-0001d180: 6c64 796e 616d 6963 7320 2d2d 3e0a 3c67 ldynamics -->.<g\n-0001d190: 2069 643d 2265 6467 6531 3838 2220 636c id=\"edge188\" cl\n-0001d1a0: 6173 733d 2265 6467 6522 3e0a 3c74 6974 ass=\"edge\">.<tit\n-0001d1b0: 6c65 3e6d 6f64 756c 655f 7372 635f 6772 le>module_src_gr\n-0001d1c0: 6f6d 6163 735f 6d64 6c69 6226 2334 353b omacs_mdlib-\n-0001d1d0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0001d1e0: 726f 6d61 6373 5f65 7373 656e 7469 616c romacs_essential\n-0001d1f0: 6479 6e61 6d69 6373 3c2f 7469 746c 653e dynamics\n-0001d200: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ..\n-0001d2b0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_src_gro\n-0001d3a0: 6d61 6373 5f6d 646c 6962 2623 3435 3b26 macs_mdlib-&\n-0001d3b0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001d3c0: 6f6d 6163 735f 6d64 7479 7065 733c 2f74 omacs_mdtypes.....<\n-0001d520: 6720 6964 3d22 6564 6765 3138 3122 2063 g id=\"edge181\" c\n-0001d530: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-0001d550: 726f 6d61 6373 5f6d 646c 6962 2623 3435 romacs_mdlib-\n-0001d560: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-0001d570: 6772 6f6d 6163 735f 6669 6c65 696f 3c2f gromacs_fileio....\n-0001d780: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module_\n-0001d7f0: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n-0001d800: 6226 2334 353b 2667 743b 6d6f 6475 6c65 b->module\n-0001d810: 5f73 7263 5f67 726f 6d61 6373 5f64 6f6d _src_gromacs_dom\n-0001d820: 6465 633c 2f74 6974 6c65 3e0a 3c70 6174 dec......modul\n-0001d9e0: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n-0001d9f0: 6c69 6226 2334 353b 2667 743b 6d6f 6475 lib->modu\n-0001da00: 6c65 5f73 7263 5f67 726f 6d61 6373 5f63 le_src_gromacs_c\n-0001da10: 6f6d 6d61 6e64 6c69 6e65 3c2f 7469 746c ommandline</titl\n-0001da20: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n-0001da30: 6f6e 6522 2073 7472 6f6b 653d 2262 6c61 one\" stroke=\"bla\n-0001da40: 636b 2220 7374 726f 6b65 2d64 6173 6861 ck\" stroke-dasha\n-0001da50: 7272 6179 3d22 352c 3222 2064 3d22 4d31 rray=\"5,2\" d=\"M1\n-0001da60: 3438 302e 3734 2c2d 3635 322e 3236 4331 480.74,-652.26C1\n-0001da70: 3434 302e 3433 2c2d 3634 342e 3433 2031 440.43,-644.43 1\n-0001da80: 3336 302e 3234 2c2d 3632 372e 3934 2031 360.24,-627.94 1\n-0001da90: 3239 332e 3536 2c2d 3630 382e 3720 3131 293.56,-608.7 11\n-0001daa0: 3732 2e32 342c 2d35 3733 2e36 3920 3836 72.24,-573.69 86\n-0001dab0: 362e 3234 2c2d 3438 342e 3337 2037 3537 6.24,-484.37 757\n-0001dac0: 2e35 362c 2d34 3230 2e30 3920 3633 372e .56,-420.09 637.\n-0001dad0: 3334 2c2d 3334 382e 3939 2035 3232 2e30 34,-348.99 522.0\n-0001dae0: 372c 2d32 3234 2e34 3420 3437 392e 3637 7,-224.44 479.67\n-0001daf0: 2c2d 3137 362e 3132 222f 3e0a 3c70 6f6c ,-176.12\"/>.<pol\n-0001db00: 7967 6f6e 2066 696c 6c3d 2262 6c61 636b ygon fill=\"black\n-0001db10: 2220 7374 726f 6b65 3d22 626c 6163 6b22 \" stroke=\"black\"\n-0001db20: 2070 6f69 6e74 733d 2234 3832 2e32 362c points=\"482.26,\n-0001db30: 2d31 3733 2e37 3720 3437 332e 3035 2c2d -173.77 473.05,-\n-0001db40: 3136 382e 3533 2034 3736 2e39 382c 2d31 168.53 476.98,-1\n-0001db50: 3738 2e33 3720 3438 322e 3236 2c2d 3137 78.37 482.26,-17\n-0001db60: 332e 3737 222f 3e0a 3c2f 673e 0a3c 212d 3.77\"/>.</g>.<!-\n-0001db70: 2d20 6d6f 6475 6c65 5f73 7263 5f67 726f - module_src_gro\n-0001db80: 6d61 6373 5f6d 646c 6962 2623 3435 3b26 macs_mdlib-&\n-0001db90: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001dba0: 6f6d 6163 735f 7472 616a 6563 746f 7279 omacs_trajectory\n-0001dbb0: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n-0001dbc0: 3138 3222 2063 6c61 7373 3d22 6564 6765 182\" class=\"edge\n-0001dbd0: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n-0001dbe0: 5f73 7263 5f67 726f 6d61 6373 5f6d 646c _src_gromacs_mdl\n-0001dbf0: 6962 2623 3435 3b26 6774 3b6d 6f64 756c ib->modul\n-0001dc00: 655f 7372 635f 6772 6f6d 6163 735f 7472 e_src_gromacs_tr\n-0001dc10: 616a 6563 746f 7279 3c2f 7469 746c 653e ajectory\n-0001dc20: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e .....\n-0001ddc0: 3c67 2069 643d 2265 6467 6531 3839 2220 .module_src_\n-0001ddf0: 6772 6f6d 6163 735f 6d64 6c69 6226 2334 gromacs_mdlib\n-0001de00: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001de10: 5f67 726f 6d61 6373 5f65 7761 6c64 3c2f _gromacs_ewald......module_src_gro\n-0001df80: 6d61 6373 5f6d 646c 6962 2623 3435 3b26 macs_mdlib-&\n-0001df90: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n-0001dfa0: 6f6d 6163 735f 6170 706c 6965 645f 666f omacs_applied_fo\n-0001dfb0: 7263 6573 5f61 7768 3c2f 7469 746c 653e rces_awh\n-0001dfc0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e .\n-0001e070: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....mo\n-0001e150: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0001e160: 5f66 696c 6569 6f26 2334 353b 2667 743b _fileio->\n-0001e170: 6d6f 6475 6c65 5f73 7263 5f74 6573 7475 module_src_testu\n-0001e180: 7469 6c73 3c2f 7469 746c 653e 0a3c 7061 tils.......\n+0001be60: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0001be70: 6373 5f65 6e65 7267 7961 6e61 6c79 7369 cs_energyanalysi\n+0001be80: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n+0001be90: 5f73 7263 5f67 726f 6d61 6373 5f73 7461 _src_gromacs_sta\n+0001bea0: 7469 7374 6963 733c 2f74 6974 6c65 3e0a tistics.\n+0001beb0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 \n+0001bf30: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....modu\n+0001c020: 6c65 5f73 7263 5f67 726f 6d61 6373 5f65 le_src_gromacs_e\n+0001c030: 6e65 7267 7961 6e61 6c79 7369 7326 2334 nergyanalysis\n+0001c040: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+0001c050: 5f67 726f 6d61 6373 5f66 696c 6569 6f3c _gromacs_fileio<\n+0001c060: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+0001c070: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+0001c080: 3d22 2362 6662 6662 6622 2064 3d22 4d31 =\"#bfbfbf\" d=\"M1\n+0001c090: 3139 322e 3233 2c2d 3737 302e 3236 4331 192.23,-770.26C1\n+0001c0a0: 3139 312e 3134 2c2d 3735 332e 3738 2031 191.14,-753.78 1\n+0001c0b0: 3138 362e 3834 2c2d 3732 342e 3938 2031 186.84,-724.98 1\n+0001c0c0: 3137 302e 3536 2c2d 3730 372e 3537 2031 170.56,-707.57 1\n+0001c0d0: 3136 332e 3436 2c2d 3639 392e 3937 2031 163.46,-699.97 1\n+0001c0e0: 3130 372e 3238 2c2d 3638 312e 3031 2031 107.28,-681.01 1\n+0001c0f0: 3037 302e 3534 2c2d 3636 392e 3222 2f3e 070.54,-669.2\"/>\n+0001c100: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .<polygon fill=\"\n+0001c110: 2362 6662 6662 6622 2073 7472 6f6b 653d #bfbfbf\" stroke=\n+0001c120: 2223 6266 6266 6266 2220 706f 696e 7473 \"#bfbfbf\" points\n+0001c130: 3d22 3130 3731 2e33 342c 2d36 3635 2e37 =\"1071.34,-665.7\n+0001c140: 3820 3130 3630 2e37 352c 2d36 3636 2e30 8 1060.75,-666.0\n+0001c150: 3720 3130 3639 2e32 312c 2d36 3732 2e34 7 1069.21,-672.4\n+0001c160: 3520 3130 3731 2e33 342c 2d36 3635 2e37 5 1071.34,-665.7\n+0001c170: 3822 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 8\"/>.</g>.<!-- m\n+0001c180: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001c190: 735f 656e 6572 6779 616e 616c 7973 6973 s_energyanalysis\n+0001c1a0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+0001c1b0: 7372 635f 6772 6f6d 6163 735f 636f 6d6d src_gromacs_comm\n+0001c1c0: 616e 646c 696e 6520 2d2d 3e0a 3c67 2069 andline -->.<g i\n+0001c1d0: 643d 2265 6467 6531 3832 2220 636c 6173 d=\"edge182\" clas\n+0001c1e0: 733d 2265 6467 6522 3e0a 3c74 6974 6c65 s=\"edge\">.<title\n+0001c1f0: 3e6d 6f64 756c 655f 7372 635f 6772 6f6d >module_src_grom\n+0001c200: 6163 735f 656e 6572 6779 616e 616c 7973 acs_energyanalys\n+0001c210: 6973 2623 3435 3b26 6774 3b6d 6f64 756c is->modul\n+0001c220: 655f 7372 635f 6772 6f6d 6163 735f 636f e_src_gromacs_co\n+0001c230: 6d6d 616e 646c 696e 653c 2f74 6974 6c65 mmandline</title\n+0001c240: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+0001c250: 6e65 2220 7374 726f 6b65 3d22 626c 6163 ne\" stroke=\"blac\n+0001c260: 6b22 2073 7472 6f6b 652d 6461 7368 6172 k\" stroke-dashar\n+0001c270: 7261 793d 2235 2c32 2220 643d 224d 3132 ray=\"5,2\" d=\"M12\n+0001c280: 3230 2e36 322c 2d37 3732 2e31 3343 3132 20.62,-772.13C12\n+0001c290: 3436 2e37 2c2d 3736 322e 3135 2031 3238 46.7,-762.15 128\n+0001c2a0: 352e 3732 2c2d 3734 372e 3231 2031 3331 5.72,-747.21 131\n+0001c2b0: 342e 3338 2c2d 3733 362e 3234 222f 3e0a 4.38,-736.24\"/>.\n+0001c2c0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2262 <polygon fill=\"b\n+0001c2d0: 6c61 636b 2220 7374 726f 6b65 3d22 626c lack\" stroke=\"bl\n+0001c2e0: 6163 6b22 2070 6f69 6e74 733d 2231 3331 ack\" points=\"131\n+0001c2f0: 352e 3936 2c2d 3733 392e 3338 2031 3332 5.96,-739.38 132\n+0001c300: 342e 3035 2c2d 3733 322e 3534 2031 3331 4.05,-732.54 131\n+0001c310: 332e 3436 2c2d 3733 322e 3835 2031 3331 3.46,-732.85 131\n+0001c320: 352e 3936 2c2d 3733 392e 3338 222f 3e0a 5.96,-739.38\"/>.\n+0001c330: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 </g>.<!-- module\n+0001c340: 5f73 7263 5f67 726f 6d61 6373 5f63 6f6d _src_gromacs_com\n+0001c350: 6d61 6e64 6c69 6e65 2623 3435 3b26 6774 mandline->\n+0001c360: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+0001c370: 6163 735f 6f6e 6c69 6e65 6865 6c70 202d acs_onlinehelp -\n+0001c380: 2d3e 0a3c 6720 6964 3d22 6564 6765 3138 ->.<g id=\"edge18\n+0001c390: 3622 2063 6c61 7373 3d22 6564 6765 223e 6\" class=\"edge\">\n+0001c3a0: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n+0001c3b0: 7263 5f67 726f 6d61 6373 5f63 6f6d 6d61 rc_gromacs_comma\n+0001c3c0: 6e64 6c69 6e65 2623 3435 3b26 6774 3b6d ndline->m\n+0001c3d0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001c3e0: 735f 6f6e 6c69 6e65 6865 6c70 3c2f 7469 s_onlinehelp</ti\n+0001c3f0: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n+0001c400: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n+0001c410: 3238 3266 6363 2220 643d 224d 3133 3933 282fcc\" d=\"M1393\n+0001c420: 2e30 372c 2d37 3132 2e37 3343 3134 3434 .07,-712.73C1444\n+0001c430: 2e34 372c 2d37 3033 2e36 3120 3135 3334 .47,-703.61 1534\n+0001c440: 2e36 332c 2d36 3837 2e32 3720 3136 3131 .63,-687.27 1611\n+0001c450: 2e35 362c 2d36 3731 2e35 3720 3136 3135 .56,-671.57 1615\n+0001c460: 2e37 332c 2d36 3730 2e37 3220 3136 3230 .73,-670.72 1620\n+0001c470: 2e30 372c 2d36 3639 2e38 3120 3136 3234 .07,-669.81 1624\n+0001c480: 2e34 312c 2d36 3638 2e38 3722 2f3e 0a3c .41,-668.87\"/>.<\n+0001c490: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+0001c4a0: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+0001c4b0: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+0001c4c0: 3136 3235 2e34 312c 2d36 3732 2e32 3420 1625.41,-672.24 \n+0001c4d0: 3136 3334 2e34 342c 2d36 3636 2e36 3920 1634.44,-666.69 \n+0001c4e0: 3136 3233 2e39 322c 2d36 3635 2e34 2031 1623.92,-665.4 1\n+0001c4f0: 3632 352e 3431 2c2d 3637 322e 3234 222f 625.41,-672.24\"/\n+0001c500: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >.</g>.<!-- modu\n+0001c510: 6c65 5f73 7263 5f67 726f 6d61 6373 5f63 le_src_gromacs_c\n+0001c520: 6f6d 6d61 6e64 6c69 6e65 2623 3435 3b26 ommandline-&\n+0001c530: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+0001c540: 6f6d 6163 735f 6f70 7469 6f6e 7320 2d2d omacs_options --\n+0001c550: 3e0a 3c67 2069 643d 2265 6467 6531 3837 >.<g id=\"edge187\n+0001c560: 2220 636c 6173 733d 2265 6467 6522 3e0a \" class=\"edge\">.\n+0001c570: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 <title>module_sr\n+0001c580: 635f 6772 6f6d 6163 735f 636f 6d6d 616e c_gromacs_comman\n+0001c590: 646c 696e 6526 2334 353b 2667 743b 6d6f dline->mo\n+0001c5a0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0001c5b0: 5f6f 7074 696f 6e73 3c2f 7469 746c 653e _options\n+0001c5c0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ..\n+0001c6a0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ...<\n+0001ca80: 6720 6964 3d22 6564 6765 3139 3522 2063 g id=\"edge195\" c\n+0001ca90: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+0001cab0: 726f 6d61 6373 5f74 6f6f 6c73 2623 3435 romacs_tools-\n+0001cac0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0001cad0: 6772 6f6d 6163 735f 7261 6e64 6f6d 3c2f gromacs_random.....<\n+0001d030: 6720 6964 3d22 6564 6765 3139 3722 2063 g id=\"edge197\" c\n+0001d040: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+0001d060: 726f 6d61 6373 5f74 6f6f 6c73 2623 3435 romacs_tools-\n+0001d070: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0001d080: 6772 6f6d 6163 735f 6666 743c 2f74 6974 gromacs_fft....\n+0001d240: 0a3c 6720 6964 3d22 6564 6765 3139 3222 ..<\n+0001d260: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+0001d270: 5f67 726f 6d61 6373 5f74 6f6f 6c73 2623 _gromacs_tools&#\n+0001d280: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+0001d290: 635f 6772 6f6d 6163 735f 6d64 7275 6e3c c_gromacs_mdrun<\n+0001d2a0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>......\n+0001d520: 3c74 6974 6c65 3e6d 6f64 756c 655f 7372 module_sr\n+0001d530: 635f 6772 6f6d 6163 735f 746f 6f6c 7326 c_gromacs_tools&\n+0001d540: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+0001d550: 7263 5f67 726f 6d61 6373 5f67 6d78 6c69 rc_gromacs_gmxli\n+0001d560: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b....\n+0001d6e0: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module\n+0001d750: 5f73 7263 5f67 726f 6d61 6373 5f74 6f6f _src_gromacs_too\n+0001d760: 6c73 2623 3435 3b26 6774 3b6d 6f64 756c ls->modul\n+0001d770: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n+0001d780: 7479 7065 733c 2f74 6974 6c65 3e0a 3c70 types...\n+0001d8a0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ..\n+0001d8f0: 3c67 2069 643d 2265 6467 6531 3931 2220 .module_src_\n+0001d920: 6772 6f6d 6163 735f 746f 6f6c 7326 2334 gromacs_tools\n+0001d930: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+0001d940: 5f67 726f 6d61 6373 5f67 6d78 7072 6570 _gromacs_gmxprep\n+0001d950: 726f 6365 7373 3c2f 7469 746c 653e 0a3c rocess.<\n+0001d960: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n+0001d970: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n+0001d980: 2220 643d 224d 3933 302e 3532 2c2d 3132 \" d=\"M930.52,-12\n+0001d990: 3134 2e37 3643 3935 332e 3938 2c2d 3132 14.76C953.98,-12\n+0001d9a0: 3035 2e31 3120 3939 332e 3339 2c2d 3131 05.11 993.39,-11\n+0001d9b0: 3838 2e39 2031 3032 322e 332c 2d31 3137 88.9 1022.3,-117\n+0001d9c0: 372e 3031 222f 3e0a 3c70 6f6c 7967 6f6e 7.01\"/>.....modul\n+0001dab0: 655f 7372 635f 6772 6f6d 6163 735f 746f e_src_gromacs_to\n+0001dac0: 6f6c 7326 2334 353b 2667 743b 6d6f 6475 ols->modu\n+0001dad0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+0001dae0: 646c 6962 3c2f 7469 746c 653e 0a3c 7061 dlib......module_src_gr\n+0001dcd0: 6f6d 6163 735f 746f 6f6c 7326 2334 353b omacs_tools-\n+0001dce0: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+0001dcf0: 726f 6d61 6373 5f66 696c 6569 6f3c 2f74 romacs_fileio..\n+0001de60: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....modul\n+0001e150: 655f 7372 635f 6772 6f6d 6163 735f 746f e_src_gromacs_to\n+0001e160: 6f6c 7326 2334 353b 2667 743b 6d6f 6475 ols->modu\n+0001e170: 6c65 5f73 7263 5f67 726f 6d61 6373 5f65 le_src_gromacs_e\n+0001e180: 7761 6c64 3c2f 7469 746c 653e 0a3c 7061 wald....<\n-0001e340: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-0001e350: 726f 6d61 6373 5f66 696c 6569 6f26 2334 romacs_fileio\n-0001e360: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001e370: 5f67 726f 6d61 6373 5f6d 6f64 756c 6172 _gromacs_modular\n-0001e380: 7369 6d75 6c61 746f 7220 2d2d 3e0a 3c67 simulator -->..module_src_gr\n-0001e3c0: 6f6d 6163 735f 6669 6c65 696f 2623 3435 omacs_fileio-\n-0001e3d0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-0001e3e0: 6772 6f6d 6163 735f 6d6f 6475 6c61 7273 gromacs_modulars\n-0001e3f0: 696d 756c 6174 6f72 3c2f 7469 746c 653e imulator\n-0001e400: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ......mo\n-0001e670: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0001e680: 5f66 696c 6569 6f26 2334 353b 2667 743b _fileio->\n-0001e690: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-0001e6a0: 6373 5f6d 6472 756e 7574 696c 6974 793c cs_mdrunutility<\n-0001e6b0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n-0001e6c0: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n-0001e6d0: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n-0001e6e0: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n-0001e6f0: 2220 643d 224d 3136 3432 2e35 2c2d 3130 \" d=\"M1642.5,-10\n-0001e700: 332e 3937 4331 3635 392e 3737 2c2d 3132 3.97C1659.77,-12\n-0001e710: 302e 3837 2031 3638 392e 3339 2c2d 3135 0.87 1689.39,-15\n-0001e720: 332e 3434 2031 3732 322e 3536 2c2d 3136 3.44 1722.56,-16\n-0001e730: 382e 3631 2032 3032 342e 3332 2c2d 3330 8.61 2024.32,-30\n-0001e740: 362e 3620 3231 3530 2e35 332c 2d31 3534 6.6 2150.53,-154\n-0001e750: 2e36 3320 3234 3632 2e35 362c 2d32 3637 .63 2462.56,-267\n-0001e760: 2e34 3820 3235 3131 2e39 332c 2d32 3835 .48 2511.93,-285\n-0001e770: 2e33 3420 3235 3337 2e31 372c 2d32 3834 .34 2537.17,-284\n-0001e780: 2e34 2032 3536 322e 3536 2c2d 3333 302e .4 2562.56,-330.\n-0001e790: 3335 2032 3539 352e 3336 2c2d 3338 392e 35 2595.36,-389.\n-0001e7a0: 3732 2032 3536 382e 3737 2c2d 3431 352e 72 2568.77,-415.\n-0001e7b0: 3432 2032 3536 322e 3536 2c2d 3438 322e 42 2562.56,-482.\n-0001e7c0: 3936 2032 3535 312e 3631 2c2d 3630 312e 96 2551.61,-601.\n-0001e7d0: 3934 2032 3537 312e 3931 2c2d 3637 362e 94 2571.91,-676.\n-0001e7e0: 3235 2032 3436 372e 3536 2c2d 3733 342e 25 2467.56,-734.\n-0001e7f0: 3434 2032 3430 302e 3131 2c2d 3737 322e 44 2400.11,-772.\n-0001e800: 3036 2032 3336 392e 3435 2c2d 3734 322e 06 2369.45,-742.\n-0001e810: 3233 2032 3239 372e 3536 2c2d 3737 302e 23 2297.56,-770.\n-0001e820: 3434 2032 3232 352e 3234 2c2d 3739 382e 44 2225.24,-798.\n-0001e830: 3832 2032 3232 312e 3633 2c2d 3833 362e 82 2221.63,-836.\n-0001e840: 3737 2032 3134 372e 3536 2c2d 3836 302e 77 2147.56,-860.\n-0001e850: 3138 2032 3033 342e 3634 2c2d 3839 352e 18 2034.64,-895.\n-0001e860: 3837 2031 3637 352e 3933 2c2d 3930 352e 87 1675.93,-905.\n-0001e870: 3438 2031 3533 352e 3034 2c2d 3930 372e 48 1535.04,-907.\n-0001e880: 3838 222f 3e0a 3c70 6f6c 7967 6f6e 2066 88\"/>.<polygon f\n-0001e890: 696c 6c3d 2223 3238 3266 6363 2220 7374 ill=\"#282fcc\" st\n-0001e8a0: 726f 6b65 3d22 2332 3832 6663 6322 2070 roke=\"#282fcc\" p\n-0001e8b0: 6f69 6e74 733d 2231 3533 342e 3832 2c2d oints=\"1534.82,-\n-0001e8c0: 3930 342e 3338 2031 3532 342e 3838 2c2d 904.38 1524.88,-\n-0001e8d0: 3930 382e 3034 2031 3533 342e 3934 2c2d 908.04 1534.94,-\n-0001e8e0: 3931 312e 3338 2031 3533 342e 3832 2c2d 911.38 1534.82,-\n-0001e8f0: 3930 342e 3338 222f 3e0a 3c2f 673e 0a3c 904.38\"/>.</g>.<\n-0001e900: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-0001e910: 726f 6d61 6373 5f66 696c 6569 6f26 2334 romacs_fileio\n-0001e920: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001e930: 5f67 726f 6d61 6373 5f6d 6473 7061 6e20 _gromacs_mdspan \n-0001e940: 2d2d 3e0a 3c67 2069 643d 2265 6467 6531 -->.<g id=\"edge1\n-0001e950: 3933 2220 636c 6173 733d 2265 6467 6522 93\" class=\"edge\"\n-0001e960: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n-0001e970: 7372 635f 6772 6f6d 6163 735f 6669 6c65 src_gromacs_file\n-0001e980: 696f 2623 3435 3b26 6774 3b6d 6f64 756c io->modul\n-0001e990: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n-0001e9a0: 7370 616e 3c2f 7469 746c 653e 0a3c 7061 span...\n-0001ea80: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...m\n-0001eaf0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001eb00: 735f 6669 6c65 696f 2623 3435 3b26 6774 s_fileio->\n-0001eb10: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-0001eb20: 6163 735f 676d 786c 6962 3c2f 7469 746c acs_gmxlib</titl\n-0001eb30: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n-0001eb40: 6f6e 6522 2073 7472 6f6b 653d 2223 6266 one\" stroke=\"#bf\n-0001eb50: 6266 6266 2220 643d 224d 3136 3031 2e39 bfbf\" d=\"M1601.9\n-0001eb60: 382c 2d39 342e 3937 4331 3536 322e 3839 8,-94.97C1562.89\n-0001eb70: 2c2d 3938 2e34 3820 3134 3838 2e37 372c ,-98.48 1488.77,\n-0001eb80: 2d31 3039 2e32 3320 3134 3335 2e35 362c -109.23 1435.56,\n-0001eb90: 2d31 3431 2e37 3420 3134 3133 2e32 382c -141.74 1413.28,\n-0001eba0: 2d31 3535 2e33 3520 3133 3934 2e34 332c -155.35 1394.43,\n-0001ebb0: 2d31 3738 2e39 3120 3133 3832 2e36 352c -178.91 1382.65,\n-0001ebc0: 2d31 3936 2e30 3622 2f3e 0a3c 706f 6c79 -196.06\"/>.<poly\n-0001ebd0: 676f 6e20 6669 6c6c 3d22 2362 6662 6662 gon fill=\"#bfbfb\n-0001ebe0: 6622 2073 7472 6f6b 653d 2223 6266 6266 f\" stroke=\"#bfbf\n-0001ebf0: 6266 2220 706f 696e 7473 3d22 3133 3739 bf\" points=\"1379\n-0001ec00: 2e34 352c 2d31 3934 2e35 3520 3133 3736 .45,-194.55 1376\n-0001ec10: 2e38 352c 2d32 3034 2e38 3320 3133 3835 .85,-204.83 1385\n-0001ec20: 2e32 392c 2d31 3938 2e34 3120 3133 3739 .29,-198.41 1379\n-0001ec30: 2e34 352c 2d31 3934 2e35 3522 2f3e 0a3c .45,-194.55\"/>.<\n-0001ec40: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.<!-- module_\n-0001ec50: 7372 635f 6772 6f6d 6163 735f 6669 6c65 src_gromacs_file\n-0001ec60: 696f 2623 3435 3b26 6774 3b6d 6f64 756c io->modul\n-0001ec70: 655f 7372 635f 6772 6f6d 6163 735f 636f e_src_gromacs_co\n-0001ec80: 6d70 6174 202d 2d3e 0a3c 6720 6964 3d22 mpat -->.<g id=\"\n-0001ec90: 6564 6765 3139 3622 2063 6c61 7373 3d22 edge196\" class=\"\n-0001eca0: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n-0001ecb0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-0001ecc0: 5f66 696c 6569 6f26 2334 353b 2667 743b _fileio->\n-0001ecd0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-0001ece0: 6373 5f63 6f6d 7061 743c 2f74 6974 6c65 cs_compat</title\n-0001ecf0: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n-0001ed00: 6e65 2220 7374 726f 6b65 3d22 2332 3832 ne\" stroke=\"#282\n-0001ed10: 6663 6322 2073 7472 6f6b 652d 6461 7368 fcc\" stroke-dash\n-0001ed20: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n-0001ed30: 3136 3532 2e36 392c 2d38 362e 3137 4331 1652.69,-86.17C1\n-0001ed40: 3636 352e 3634 2c2d 3833 2e35 3920 3136 665.64,-83.59 16\n-0001ed50: 3831 2e39 312c 2d38 302e 3635 2031 3639 81.91,-80.65 169\n-0001ed60: 362e 3536 2c2d 3738 2e38 3720 3139 3739 6.56,-78.87 1979\n-0001ed70: 2e36 342c 2d34 342e 3436 2032 3332 322e .64,-44.46 2322.\n-0001ed80: 3736 2c2d 3334 2e30 3320 3234 3433 2e37 76,-34.03 2443.7\n-0001ed90: 342c 2d33 312e 3322 2f3e 0a3c 706f 6c79 4,-31.3\"/>.<poly\n-0001eda0: 676f 6e20 6669 6c6c 3d22 2332 3832 6663 gon fill=\"#282fc\n-0001edb0: 6322 2073 7472 6f6b 653d 2223 3238 3266 c\" stroke=\"#282f\n-0001edc0: 6363 2220 706f 696e 7473 3d22 3234 3434 cc\" points=\"2444\n-0001edd0: 2e31 352c 2d33 342e 3739 2032 3435 342e .15,-34.79 2454.\n-0001ede0: 3037 2c2d 3331 2e30 3720 3234 3434 2c2d 07,-31.07 2444,-\n-0001edf0: 3237 2e37 3920 3234 3434 2e31 352c 2d33 27.79 2444.15,-3\n-0001ee00: 342e 3739 222f 3e0a 3c2f 673e 0a3c 212d 4.79\"/>.</g>.<!-\n-0001ee10: 2d20 6d6f 6475 6c65 5f73 7263 5f67 726f - module_src_gro\n-0001ee20: 6d61 6373 5f66 696c 6569 6f26 2334 353b macs_fileio-\n-0001ee30: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0001ee40: 726f 6d61 6373 5f6d 6474 7970 6573 202d romacs_mdtypes -\n-0001ee50: 2d3e 0a3c 6720 6964 3d22 6564 6765 3139 ->.<g id=\"edge19\n-0001ee60: 3522 2063 6c61 7373 3d22 6564 6765 223e 5\" class=\"edge\">\n-0001ee70: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n-0001ee80: 7263 5f67 726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n-0001ee90: 6f26 2334 353b 2667 743b 6d6f 6475 6c65 o->module\n-0001eea0: 5f73 7263 5f67 726f 6d61 6373 5f6d 6474 _src_gromacs_mdt\n-0001eeb0: 7970 6573 3c2f 7469 746c 653e 0a3c 7061 ypes....<\n-0001f080: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-0001f090: 726f 6d61 6373 5f66 696c 6569 6f26 2334 romacs_fileio\n-0001f0a0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001f0b0: 5f67 726f 6d61 6373 5f74 7261 6a65 6374 _gromacs_traject\n-0001f0c0: 6f72 7920 2d2d 3e0a 3c67 2069 643d 2265 ory -->..mod\n-0001f0f0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0001f100: 6669 6c65 696f 2623 3435 3b26 6774 3b6d fileio->m\n-0001f110: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001f120: 735f 7472 616a 6563 746f 7279 3c2f 7469 s_trajectory</ti\n-0001f130: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-0001f140: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-0001f150: 6266 6266 6266 2220 643d 224d 3136 3031 bfbfbf\" d=\"M1601\n-0001f160: 2e37 2c2d 3930 2e31 4331 3433 352c 2d38 .7,-90.1C1435,-8\n-0001f170: 322e 3634 2035 3431 2e36 392c 2d34 322e 2.64 541.69,-42.\n-0001f180: 3636 2033 3138 2e39 312c 2d33 322e 3639 66 318.91,-32.69\n-0001f190: 222f 3e0a 3c70 6f6c 7967 6f6e 2066 696c \"/>.<polygon fil\n-0001f1a0: 6c3d 2223 6266 6266 6266 2220 7374 726f l=\"#bfbfbf\" stro\n-0001f1b0: 6b65 3d22 2362 6662 6662 6622 2070 6f69 ke=\"#bfbfbf\" poi\n-0001f1c0: 6e74 733d 2233 3138 2e39 362c 2d32 392e nts=\"318.96,-29.\n-0001f1d0: 3139 2033 3038 2e38 322c 2d33 322e 3234 19 308.82,-32.24\n-0001f1e0: 2033 3138 2e36 352c 2d33 362e 3138 2033 318.65,-36.18 3\n-0001f1f0: 3138 2e39 362c 2d32 392e 3139 222f 3e0a 18.96,-29.19\"/>.\n-0001f200: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 </g>.<!-- module\n-0001f210: 5f73 7263 5f67 726f 6d61 6373 5f66 696c _src_gromacs_fil\n-0001f220: 6569 6f26 2334 353b 2667 743b 6d6f 6475 eio->modu\n-0001f230: 6c65 5f73 7263 5f67 726f 6d61 6373 5f61 le_src_gromacs_a\n-0001f240: 7070 6c69 6564 5f66 6f72 6365 735f 6177 pplied_forces_aw\n-0001f250: 6820 2d2d 3e0a 3c67 2069 643d 2265 6467 h -->.<g id=\"edg\n-0001f260: 6531 3934 2220 636c 6173 733d 2265 6467 e194\" class=\"edg\n-0001f270: 6522 3e0a 3c74 6974 6c65 3e6d 6f64 756c e\">.<title>modul\n-0001f280: 655f 7372 635f 6772 6f6d 6163 735f 6669 e_src_gromacs_fi\n-0001f290: 6c65 696f 2623 3435 3b26 6774 3b6d 6f64 leio->mod\n-0001f2a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0001f2b0: 6170 706c 6965 645f 666f 7263 6573 5f61 applied_forces_a\n-0001f2c0: 7768 3c2f 7469 746c 653e 0a3c 7061 7468 wh......modul\n-0001f490: 655f 7372 635f 6772 6f6d 6163 735f 646f e_src_gromacs_do\n-0001f4a0: 6d64 6563 2623 3435 3b26 6774 3b6d 6f64 mdec->mod\n-0001f4b0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0001f4c0: 6770 755f 7574 696c 733c 2f74 6974 6c65 gpu_utils</title\n-0001f4d0: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n-0001f4e0: 6e65 2220 7374 726f 6b65 3d22 2362 6662 ne\" stroke=\"#bfb\n-0001f4f0: 6662 6622 2064 3d22 4d31 3937 372e 3532 fbf\" d=\"M1977.52\n-0001f500: 2c2d 3534 352e 3834 4331 3935 382e 3136 ,-545.84C1958.16\n-0001f510: 2c2d 3538 352e 3737 2031 3839 372e 3434 ,-585.77 1897.44\n-0001f520: 2c2d 3731 302e 3936 2031 3837 322e 3935 ,-710.96 1872.95\n-0001f530: 2c2d 3736 312e 3435 222f 3e0a 3c70 6f6c ,-761.45\"/>.<pol\n-0001f540: 7967 6f6e 2066 696c 6c3d 2223 6266 6266 ygon fill=\"#bfbf\n-0001f550: 6266 2220 7374 726f 6b65 3d22 2362 6662 bf\" stroke=\"#bfb\n-0001f560: 6662 6622 2070 6f69 6e74 733d 2231 3836 fbf\" points=\"186\n-0001f570: 392e 3738 2c2d 3735 392e 3938 2031 3836 9.78,-759.98 186\n-0001f580: 382e 3536 2c2d 3737 302e 3520 3138 3736 8.56,-770.5 1876\n-0001f590: 2e30 372c 2d37 3633 2e30 3320 3138 3639 .07,-763.03 1869\n-0001f5a0: 2e37 382c 2d37 3539 2e39 3822 2f3e 0a3c .78,-759.98\"/>.<\n-0001f5b0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.<!-- module_\n-0001f5c0: 7372 635f 6772 6f6d 6163 735f 646f 6d64 src_gromacs_domd\n-0001f5d0: 6563 2623 3435 3b26 6774 3b6d 6f64 756c ec->modul\n-0001f5e0: 655f 7372 635f 6772 6f6d 6163 735f 6d64 e_src_gromacs_md\n-0001f5f0: 7275 6e75 7469 6c69 7479 202d 2d3e 0a3c runutility -->.<\n-0001f600: 6720 6964 3d22 6564 6765 3230 3822 2063 g id=\"edge208\" c\n-0001f610: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.<ti\n-0001f620: 746c 653e 6d6f 6475 6c65 5f73 7263 5f67 tle>module_src_g\n-0001f630: 726f 6d61 6373 5f64 6f6d 6465 6326 2334 romacs_domdec\n-0001f640: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001f650: 5f67 726f 6d61 6373 5f6d 6472 756e 7574 _gromacs_mdrunut\n-0001f660: 696c 6974 793c 2f74 6974 6c65 3e0a 3c70 ility..\n-0001f7c0: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module_src_gro\n-0001f840: 6d61 6373 5f64 6f6d 6465 6326 2334 353b macs_domdec-\n-0001f850: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-0001f860: 726f 6d61 6373 5f68 6172 6477 6172 653c romacs_hardware<\n-0001f870: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.\n-0001f910: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....module\n-0001fa00: 5f73 7263 5f67 726f 6d61 6373 5f64 6f6d _src_gromacs_dom\n-0001fa10: 6465 6326 2334 353b 2667 743b 6d6f 6475 dec->modu\n-0001fa20: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6c le_src_gromacs_l\n-0001fa30: 6973 7465 645f 666f 7263 6573 3c2f 7469 isted_forces</ti\n-0001fa40: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-0001fa50: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-0001fa60: 3238 3266 6363 2220 7374 726f 6b65 2d64 282fcc\" stroke-d\n-0001fa70: 6173 6861 7272 6179 3d22 352c 3222 2064 asharray=\"5,2\" d\n-0001fa80: 3d22 4d31 3939 302e 362c 2d35 3139 2e30 =\"M1990.6,-519.0\n-0001fa90: 3843 3139 3939 2e35 382c 2d35 3039 2e37 8C1999.58,-509.7\n-0001faa0: 3620 3230 3133 2e37 382c 2d34 3936 2e33 6 2013.78,-496.3\n-0001fab0: 3220 3230 3234 2e35 362c 2d34 3832 2e39 2 2024.56,-482.9\n-0001fac0: 3620 3230 3235 2e36 332c 2d34 3831 2e36 6 2025.63,-481.6\n-0001fad0: 3320 3230 3734 2e32 312c 2d34 3033 2e33 3 2074.21,-403.3\n-0001fae0: 3820 3231 3031 2e37 362c 2d33 3635 2e32 8 2101.76,-365.2\n-0001faf0: 3422 2f3e 0a3c 706f 6c79 676f 6e20 6669 4\"/>.<polygon fi\n-0001fb00: 6c6c 3d22 2332 3832 6663 6322 2073 7472 ll=\"#282fcc\" str\n-0001fb10: 6f6b 653d 2223 3238 3266 6363 2220 706f oke=\"#282fcc\" po\n-0001fb20: 696e 7473 3d22 3231 3034 2e38 2c2d 3336 ints=\"2104.8,-36\n-0001fb30: 372e 3032 2032 3130 372e 3934 2c2d 3335 7.02 2107.94,-35\n-0001fb40: 362e 3920 3230 3939 2e31 372c 2d33 3632 6.9 2099.17,-362\n-0001fb50: 2e38 3520 3231 3034 2e38 2c2d 3336 372e .85 2104.8,-367.\n-0001fb60: 3032 222f 3e0a 3c2f 673e 0a3c 212d 2d20 02\"/>.</g>.<!-- \n-0001fb70: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-0001fb80: 6373 5f64 6f6d 6465 6326 2334 353b 2667 cs_domdec-&g\n-0001fb90: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-0001fba0: 6d61 6373 5f6e 626e 786d 202d 2d3e 0a3c macs_nbnxm -->.<\n-0001fbb0: 6720 6964 3d22 6564 6765 3230 3922 2063 g id=\"edge209\" c\n-0001fbc0: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.<ti\n-0001fbd0: 746c 653e 6d6f 6475 6c65 5f73 7263 5f67 tle>module_src_g\n-0001fbe0: 726f 6d61 6373 5f64 6f6d 6465 6326 2334 romacs_domdec\n-0001fbf0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-0001fc00: 5f67 726f 6d61 6373 5f6e 626e 786d 3c2f _gromacs_nbnxm</\n-0001fc10: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-0001fc20: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-0001fc30: 2223 3238 3266 6363 2220 7374 726f 6b65 \"#282fcc\" stroke\n-0001fc40: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n-0001fc50: 2064 3d22 4d31 3938 352e 3636 2c2d 3531 d=\"M1985.66,-51\n-0001fc60: 382e 3934 4331 3939 302e 3835 2c2d 3530 8.94C1990.85,-50\n-0001fc70: 392e 3534 2031 3939 392e 3533 2c2d 3439 9.54 1999.53,-49\n-0001fc80: 362e 3038 2032 3030 342e 3536 2c2d 3438 6.08 2004.56,-48\n-0001fc90: 322e 3936 2032 3032 382e 3233 2c2d 3432 2.96 2028.23,-42\n-0001fca0: 312e 3138 2032 3033 362e 3532 2c2d 3334 1.18 2036.52,-34\n-0001fcb0: 322e 3636 2032 3034 322e 3736 2c2d 3330 2.66 2042.76,-30\n-0001fcc0: 342e 3632 222f 3e0a 3c70 6f6c 7967 6f6e 4.62\"/>.<polygon\n-0001fcd0: 2066 696c 6c3d 2223 3238 3266 6363 2220 fill=\"#282fcc\" \n-0001fce0: 7374 726f 6b65 3d22 2332 3832 6663 6322 stroke=\"#282fcc\"\n-0001fcf0: 2070 6f69 6e74 733d 2232 3034 362e 3234 points=\"2046.24\n-0001fd00: 2c2d 3330 352e 3035 2032 3034 342e 3536 ,-305.05 2044.56\n-0001fd10: 2c2d 3239 342e 3539 2032 3033 392e 3335 ,-294.59 2039.35\n-0001fd20: 2c2d 3330 332e 3832 2032 3034 362e 3234 ,-303.82 2046.24\n-0001fd30: 2c2d 3330 352e 3035 222f 3e0a 3c2f 673e ,-305.05\"/>.</g>\n-0001fd40: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 .<!-- module_src\n-0001fd50: 5f67 726f 6d61 6373 5f64 6f6d 6465 6326 _gromacs_domdec&\n-0001fd60: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-0001fd70: 7263 5f67 726f 6d61 6373 5f6d 6472 756e rc_gromacs_mdrun\n-0001fd80: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n-0001fd90: 3231 3222 2063 6c61 7373 3d22 6564 6765 212\" class=\"edge\n-0001fda0: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n-0001fdb0: 5f73 7263 5f67 726f 6d61 6373 5f64 6f6d _src_gromacs_dom\n-0001fdc0: 6465 6326 2334 353b 2667 743b 6d6f 6475 dec->modu\n-0001fdd0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n-0001fde0: 6472 756e 3c2f 7469 746c 653e 0a3c 7061 drun..\n-0001ff10: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....mod\n-0001ff80: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-0001ff90: 646f 6d64 6563 2623 3435 3b26 6774 3b6d domdec->m\n-0001ffa0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-0001ffb0: 735f 696d 643c 2f74 6974 6c65 3e0a 3c70 s_imd..<\n-00020040: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n-00020050: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n-00020060: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n-00020070: 3134 3132 2e39 392c 2d34 3131 2e38 3320 1412.99,-411.83 \n-00020080: 3134 3032 2e34 382c 2d34 3133 2e31 3620 1402.48,-413.16 \n-00020090: 3134 3131 2e35 332c 2d34 3138 2e36 3820 1411.53,-418.68 \n-000200a0: 3134 3132 2e39 392c 2d34 3131 2e38 3322 1412.99,-411.83\"\n-000200b0: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />....module_src_gro\n-00020130: 6d61 6373 5f64 6f6d 6465 6326 2334 353b macs_domdec-\n-00020140: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-00020150: 726f 6d61 6373 5f67 6d78 6c69 623c 2f74 romacs_gmxlib...\n-000202d0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...modul\n-00020340: 655f 7372 635f 6772 6f6d 6163 735f 646f e_src_gromacs_do\n-00020350: 6d64 6563 2623 3435 3b26 6774 3b6d 6f64 mdec->mod\n-00020360: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00020370: 636f 6d70 6174 3c2f 7469 746c 653e 0a3c compat.<\n-00020380: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00020390: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n-000203a0: 2220 643d 224d 3230 3139 2e31 2c2d 3532 \" d=\"M2019.1,-52\n-000203b0: 392e 3731 4332 3039 342e 3639 2c2d 3532 9.71C2094.69,-52\n-000203c0: 352e 3538 2032 3236 382e 3538 2c2d 3531 5.58 2268.58,-51\n-000203d0: 332e 3031 2032 3331 382e 3536 2c2d 3438 3.01 2318.56,-48\n-000203e0: 322e 3936 2032 3433 342e 3139 2c2d 3431 2.96 2434.19,-41\n-000203f0: 332e 3434 2032 3436 382e 3536 2c2d 3335 3.44 2468.56,-35\n-00020400: 332e 3936 2032 3436 382e 3536 2c2d 3231 3.96 2468.56,-21\n-00020410: 392e 3035 2032 3436 382e 3536 2c2d 3231 9.05 2468.56,-21\n-00020420: 392e 3035 2032 3436 382e 3536 2c2d 3231 9.05 2468.56,-21\n-00020430: 392e 3035 2032 3436 382e 3536 2c2d 3135 9.05 2468.56,-15\n-00020440: 342e 3138 2032 3436 382e 3536 2c2d 3131 4.18 2468.56,-11\n-00020450: 382e 3335 2032 3437 362e 3833 2c2d 3737 8.35 2476.83,-77\n-00020460: 2e34 3220 3234 3832 2e37 342c 2d35 322e .42 2482.74,-52.\n-00020470: 3738 222f 3e0a 3c70 6f6c 7967 6f6e 2066 78\"/>....\n+0001e3c0: 3c67 2069 643d 2265 6467 6531 3934 2220 .module_src_\n+0001e3f0: 6772 6f6d 6163 735f 746f 6f6c 7326 2334 gromacs_tools\n+0001e400: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+0001e410: 5f67 726f 6d61 6373 5f74 7261 6a65 6374 _gromacs_traject\n+0001e420: 6f72 793c 2f74 6974 6c65 3e0a 3c70 6174 ory......module\n+0001e640: 5f73 7263 5f67 726f 6d61 6373 5f61 7070 _src_gromacs_app\n+0001e650: 6c69 6564 5f66 6f72 6365 7326 2334 353b lied_forces-\n+0001e660: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+0001e670: 726f 6d61 6373 5f6d 6472 756e 7574 696c romacs_mdrunutil\n+0001e680: 6974 793c 2f74 6974 6c65 3e0a 3c70 6174 ity...<\n+0001e810: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>.\n+0001e860: 0a3c 6720 6964 3d22 6564 6765 3231 3022 ..<\n+0001e880: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+0001e890: 5f67 726f 6d61 6373 5f61 7070 6c69 6564 _gromacs_applied\n+0001e8a0: 5f66 6f72 6365 7326 2334 353b 2667 743b _forces->\n+0001e8b0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0001e8c0: 6373 5f72 616e 646f 6d3c 2f74 6974 6c65 cs_random......mo\n+0001ea60: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0001ea70: 5f61 7070 6c69 6564 5f66 6f72 6365 7326 _applied_forces&\n+0001ea80: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+0001ea90: 7263 5f67 726f 6d61 6373 5f6d 6473 7061 rc_gromacs_mdspa\n+0001eaa0: 6e3c 2f74 6974 6c65 3e0a 3c70 6174 6820 n.\n+0001eb50: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 ...\n+0001ebc0: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module_src_gr\n+0001ec40: 6f6d 6163 735f 6170 706c 6965 645f 666f omacs_applied_fo\n+0001ec50: 7263 6573 2623 3435 3b26 6774 3b6d 6f64 rces->mod\n+0001ec60: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0001ec70: 6f70 7469 6f6e 733c 2f74 6974 6c65 3e0a options.\n+0001ec80: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .<\n+0001ed00: 706f 6c79 676f 6e20 6669 6c6c 3d22 626c polygon fill=\"bl\n+0001ed10: 6163 6b22 2073 7472 6f6b 653d 2262 6c61 ack\" stroke=\"bla\n+0001ed20: 636b 2220 706f 696e 7473 3d22 3132 3336 ck\" points=\"1236\n+0001ed30: 2e37 332c 2d33 3032 2e32 3820 3132 3432 .73,-302.28 1242\n+0001ed40: 2e33 352c 2d32 3933 2e33 2031 3233 322e .35,-293.3 1232.\n+0001ed50: 3335 2c2d 3239 362e 3832 2031 3233 362e 35,-296.82 1236.\n+0001ed60: 3733 2c2d 3330 322e 3238 222f 3e0a 3c2f 73,-302.28\"/>...\n+0001edc0: 3c67 2069 643d 2265 6467 6532 3038 2220 .module_src_\n+0001edf0: 6772 6f6d 6163 735f 6170 706c 6965 645f gromacs_applied_\n+0001ee00: 666f 7263 6573 2623 3435 3b26 6774 3b6d forces->m\n+0001ee10: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001ee20: 735f 676d 786c 6962 3c2f 7469 746c 653e s_gmxlib\n+0001ee30: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....\n+0001eff0: 0a3c 6720 6964 3d22 6564 6765 3230 3322 ..<\n+0001f010: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+0001f020: 5f67 726f 6d61 6373 5f61 7070 6c69 6564 _gromacs_applied\n+0001f030: 5f66 6f72 6365 7326 2334 353b 2667 743b _forces->\n+0001f040: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0001f050: 6373 5f6d 6474 7970 6573 3c2f 7469 746c cs_mdtypes.....\n+0001f2a0: 3c67 2069 643d 2265 6467 6532 3131 2220 .module_src_\n+0001f2d0: 6772 6f6d 6163 735f 6170 706c 6965 645f gromacs_applied_\n+0001f2e0: 666f 7263 6573 2623 3435 3b26 6774 3b6d forces->m\n+0001f2f0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001f300: 735f 676d 7870 7265 7072 6f63 6573 733c s_gmxpreprocess<\n+0001f310: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>..<\n+0001f460: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+0001f470: 6363 6332 3822 2073 7472 6f6b 653d 2223 ccc28\" stroke=\"#\n+0001f480: 3263 6363 3238 2220 706f 696e 7473 3d22 2ccc28\" points=\"\n+0001f490: 3131 3237 2e30 392c 2d31 3135 362e 3620 1127.09,-1156.6 \n+0001f4a0: 3131 3137 2e31 322c 2d31 3136 302e 3138 1117.12,-1160.18\n+0001f4b0: 2031 3132 372e 3135 2c2d 3131 3633 2e35 1127.15,-1163.5\n+0001f4c0: 3920 3131 3237 2e30 392c 2d31 3135 362e 9 1127.09,-1156.\n+0001f4d0: 3622 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6\"/>....modul\n+0001f550: 655f 7372 635f 6772 6f6d 6163 735f 6170 e_src_gromacs_ap\n+0001f560: 706c 6965 645f 666f 7263 6573 2623 3435 plied_forces-\n+0001f570: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0001f580: 6772 6f6d 6163 735f 6d64 6c69 623c 2f74 gromacs_mdlib</t\n+0001f590: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n+0001f5a0: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n+0001f5b0: 2332 3832 6663 6322 2073 7472 6f6b 652d #282fcc\" stroke-\n+0001f5c0: 6461 7368 6172 7261 793d 2235 2c32 2220 dasharray=\"5,2\" \n+0001f5d0: 643d 224d 3131 3832 2e33 322c 2d33 3330 d=\"M1182.32,-330\n+0001f5e0: 2e30 3943 3131 3835 2e34 312c 2d33 3132 .09C1185.41,-312\n+0001f5f0: 2e39 3620 3131 3933 2e35 2c2d 3238 322e .96 1193.5,-282.\n+0001f600: 3835 2031 3231 332e 3536 2c2d 3236 372e 85 1213.56,-267.\n+0001f610: 3438 2031 3235 372e 3235 2c2d 3233 342e 48 1257.25,-234.\n+0001f620: 3031 2031 3432 312e 3132 2c2d 3232 332e 01 1421.12,-223.\n+0001f630: 3432 2031 3439 362e 3336 2c2d 3232 302e 42 1496.36,-220.\n+0001f640: 3238 222f 3e0a 3c70 6f6c 7967 6f6e 2066 28\"/>.<polygon f\n+0001f650: 696c 6c3d 2223 3238 3266 6363 2220 7374 ill=\"#282fcc\" st\n+0001f660: 726f 6b65 3d22 2332 3832 6663 6322 2070 roke=\"#282fcc\" p\n+0001f670: 6f69 6e74 733d 2231 3439 362e 3531 2c2d oints=\"1496.51,-\n+0001f680: 3232 332e 3737 2031 3530 362e 3337 2c2d 223.77 1506.37,-\n+0001f690: 3231 392e 3838 2031 3439 362e 3234 2c2d 219.88 1496.24,-\n+0001f6a0: 3231 362e 3738 2031 3439 362e 3531 2c2d 216.78 1496.51,-\n+0001f6b0: 3232 332e 3737 222f 3e0a 3c2f 673e 0a3c 223.77\"/>.</g>.<\n+0001f6c0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+0001f6d0: 726f 6d61 6373 5f61 7070 6c69 6564 5f66 romacs_applied_f\n+0001f6e0: 6f72 6365 7326 2334 353b 2667 743b 6d6f orces->mo\n+0001f6f0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+0001f700: 5f66 696c 6569 6f20 2d2d 3e0a 3c67 2069 _fileio -->.<g i\n+0001f710: 643d 2265 6467 6532 3032 2220 636c 6173 d=\"edge202\" clas\n+0001f720: 733d 2265 6467 6522 3e0a 3c74 6974 6c65 s=\"edge\">.<title\n+0001f730: 3e6d 6f64 756c 655f 7372 635f 6772 6f6d >module_src_grom\n+0001f740: 6163 735f 6170 706c 6965 645f 666f 7263 acs_applied_forc\n+0001f750: 6573 2623 3435 3b26 6774 3b6d 6f64 756c es->modul\n+0001f760: 655f 7372 635f 6772 6f6d 6163 735f 6669 e_src_gromacs_fi\n+0001f770: 6c65 696f 3c2f 7469 746c 653e 0a3c 7061 leio......modul\n+0001f930: 655f 7372 635f 6772 6f6d 6163 735f 6170 e_src_gromacs_ap\n+0001f940: 706c 6965 645f 666f 7263 6573 2623 3435 plied_forces-\n+0001f950: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+0001f960: 6772 6f6d 6163 735f 646f 6d64 6563 3c2f gromacs_domdec</\n+0001f970: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+0001f980: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+0001f990: 2223 3238 3266 6363 2220 7374 726f 6b65 \"#282fcc\" stroke\n+0001f9a0: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n+0001f9b0: 2064 3d22 4d31 3233 312e 3737 2c2d 3334 d=\"M1231.77,-34\n+0001f9c0: 392e 3632 4331 3330 372e 3839 2c2d 3335 9.62C1307.89,-35\n+0001f9d0: 372e 3131 2031 3435 352e 3237 2c2d 3337 7.11 1455.27,-37\n+0001f9e0: 322e 3832 2031 3537 392e 3536 2c2d 3339 2.82 1579.56,-39\n+0001f9f0: 332e 3232 2031 3639 382e 3033 2c2d 3431 3.22 1698.03,-41\n+0001fa00: 322e 3636 2031 3833 362e 3536 2c2d 3434 2.66 1836.56,-44\n+0001fa10: 332e 3735 2031 3930 332e 3034 2c2d 3435 3.75 1903.04,-45\n+0001fa20: 392e 3139 222f 3e0a 3c70 6f6c 7967 6f6e 9.19\"/>.<polygon\n+0001fa30: 2066 696c 6c3d 2223 3238 3266 6363 2220 fill=\"#282fcc\" \n+0001fa40: 7374 726f 6b65 3d22 2332 3832 6663 6322 stroke=\"#282fcc\"\n+0001fa50: 2070 6f69 6e74 733d 2231 3930 322e 3534 points=\"1902.54\n+0001fa60: 2c2d 3436 322e 3637 2031 3931 332e 3037 ,-462.67 1913.07\n+0001fa70: 2c2d 3436 312e 3533 2031 3930 342e 3133 ,-461.53 1904.13\n+0001fa80: 2c2d 3435 352e 3835 2031 3930 322e 3534 ,-455.85 1902.54\n+0001fa90: 2c2d 3436 322e 3637 222f 3e0a 3c2f 673e ,-462.67\"/>.</g>\n+0001faa0: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 .<!-- module_src\n+0001fab0: 5f67 726f 6d61 6373 5f61 7070 6c69 6564 _gromacs_applied\n+0001fac0: 5f66 6f72 6365 7326 2334 353b 2667 743b _forces->\n+0001fad0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+0001fae0: 6373 5f63 6f6d 6d61 6e64 6c69 6e65 202d cs_commandline -\n+0001faf0: 2d3e 0a3c 6720 6964 3d22 6564 6765 3230 ->.<g id=\"edge20\n+0001fb00: 3122 2063 6c61 7373 3d22 6564 6765 223e 1\" class=\"edge\">\n+0001fb10: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n+0001fb20: 7263 5f67 726f 6d61 6373 5f61 7070 6c69 rc_gromacs_appli\n+0001fb30: 6564 5f66 6f72 6365 7326 2334 353b 2667 ed_forces-&g\n+0001fb40: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+0001fb50: 6d61 6373 5f63 6f6d 6d61 6e64 6c69 6e65 macs_commandline\n+0001fb60: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......mod\n+0001fd00: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+0001fd10: 6170 706c 6965 645f 666f 7263 6573 2623 applied_forces&#\n+0001fd20: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+0001fd30: 635f 6772 6f6d 6163 735f 6577 616c 643c c_gromacs_ewald<\n+0001fd40: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+0001fd50: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+0001fd60: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n+0001fd70: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n+0001fd80: 2220 643d 224d 3132 3331 2e33 312c 2d33 \" d=\"M1231.31,-3\n+0001fd90: 3337 2e37 3743 3133 3232 2e32 352c 2d33 37.77C1322.25,-3\n+0001fda0: 3238 2e35 3720 3135 3039 2e34 382c 2d33 28.57 1509.48,-3\n+0001fdb0: 3038 2e36 3420 3135 3733 2e35 362c 2d32 08.64 1573.56,-2\n+0001fdc0: 3934 2e33 3520 3135 3735 2e36 322c 2d32 94.35 1575.62,-2\n+0001fdd0: 3933 2e38 3920 3135 3737 2e37 342c 2d32 93.89 1577.74,-2\n+0001fde0: 3933 2e33 3620 3135 3739 2e38 352c 2d32 93.36 1579.85,-2\n+0001fdf0: 3932 2e37 3922 2f3e 0a3c 706f 6c79 676f 92.79\"/>.<polygo\n+0001fe00: 6e20 6669 6c6c 3d22 2332 3832 6663 6322 n fill=\"#282fcc\"\n+0001fe10: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n+0001fe20: 2220 706f 696e 7473 3d22 3135 3831 2e30 \" points=\"1581.0\n+0001fe30: 372c 2d32 3936 2e30 3820 3135 3839 2e36 7,-296.08 1589.6\n+0001fe40: 362c 2d32 3839 2e38 3820 3135 3739 2e30 6,-289.88 1579.0\n+0001fe50: 382c 2d32 3839 2e33 3720 3135 3831 2e30 8,-289.37 1581.0\n+0001fe60: 372c 2d32 3936 2e30 3822 2f3e 0a3c 2f67 7,-296.08\"/>.</g\n+0001fe70: 3e0a 3c21 2d2d 206d 6f64 756c 655f 7372 >.<!-- module_sr\n+0001fe80: 635f 6772 6f6d 6163 735f 7265 7374 7261 c_gromacs_restra\n+0001fe90: 696e 7426 2334 353b 2667 743b 6d6f 6475 int->modu\n+0001fea0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+0001feb0: 6d78 6c69 6220 2d2d 3e0a 3c67 2069 643d mxlib -->.<g id=\n+0001fec0: 2265 6467 6532 3134 2220 636c 6173 733d \"edge214\" class=\n+0001fed0: 2265 6467 6522 3e0a 3c74 6974 6c65 3e6d \"edge\">.<title>m\n+0001fee0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+0001fef0: 735f 7265 7374 7261 696e 7426 2334 353b s_restraint-\n+0001ff00: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+0001ff10: 726f 6d61 6373 5f67 6d78 6c69 623c 2f74 romacs_gmxlib</t\n+0001ff20: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n+0001ff30: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n+0001ff40: 2362 6662 6662 6622 2064 3d22 4d31 3938 #bfbfbf\" d=\"M198\n+0001ff50: 322e 3736 2c2d 3335 352e 3732 4332 3032 2.76,-355.72C202\n+0001ff60: 372e 392c 2d33 3834 2e33 3420 3231 3339 7.9,-384.34 2139\n+0001ff70: 2e30 322c 2d34 3634 2e38 3620 3231 3035 .02,-464.86 2105\n+0001ff80: 2e35 362c 2d35 3435 2e38 3320 3230 3537 .56,-545.83 2057\n+0001ff90: 2e31 352c 2d36 3632 2e39 3820 3139 3134 .15,-662.98 1914\n+0001ffa0: 2e35 322c 2d37 3430 2e31 3820 3138 3531 .52,-740.18 1851\n+0001ffb0: 2e33 322c 2d37 3639 2e35 3622 2f3e 0a3c .32,-769.56\"/>.<\n+0001ffc0: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n+0001ffd0: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n+0001ffe0: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n+0001fff0: 3138 3439 2e35 332c 2d37 3636 2e35 3320 1849.53,-766.53 \n+00020000: 3138 3431 2e38 382c 2d37 3733 2e38 3620 1841.88,-773.86 \n+00020010: 3138 3532 2e34 332c 2d37 3732 2e39 2031 1852.43,-772.9 1\n+00020020: 3834 392e 3533 2c2d 3736 362e 3533 222f 849.53,-766.53\"/\n+00020030: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >.</g>.<!-- modu\n+00020040: 6c65 5f73 7263 5f67 726f 6d61 6373 5f72 le_src_gromacs_r\n+00020050: 6573 7472 6169 6e74 2623 3435 3b26 6774 estraint->\n+00020060: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+00020070: 6163 735f 6d64 7479 7065 7320 2d2d 3e0a acs_mdtypes -->.\n+00020080: 3c67 2069 643d 2265 6467 6532 3135 2220 <g id=\"edge215\" \n+00020090: 636c 6173 733d 2265 6467 6522 3e0a 3c74 class=\"edge\">.<t\n+000200a0: 6974 6c65 3e6d 6f64 756c 655f 7372 635f itle>module_src_\n+000200b0: 6772 6f6d 6163 735f 7265 7374 7261 696e gromacs_restrain\n+000200c0: 7426 2334 353b 2667 743b 6d6f 6475 6c65 t->module\n+000200d0: 5f73 7263 5f67 726f 6d61 6373 5f6d 6474 _src_gromacs_mdt\n+000200e0: 7970 6573 3c2f 7469 746c 653e 0a3c 7061 ypes.\n+00020240: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....m\n+000204d0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+000204e0: 735f 6d69 6d69 6326 2334 353b 2667 743b s_mimic->\n 000204f0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00020500: 6373 5f64 6f6d 6465 6326 2334 353b 2667 cs_domdec-&g\n-00020510: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00020520: 6d61 6373 5f6d 6474 7970 6573 202d 2d3e macs_mdtypes -->\n-00020530: 0a3c 6720 6964 3d22 6564 6765 3230 3322 .<g id=\"edge203\"\n-00020540: 2063 6c61 7373 3d22 6564 6765 223e 0a3c class=\"edge\">.<\n-00020550: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00020560: 5f67 726f 6d61 6373 5f64 6f6d 6465 6326 _gromacs_domdec&\n-00020570: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00020580: 7263 5f67 726f 6d61 6373 5f6d 6474 7970 rc_gromacs_mdtyp\n-00020590: 6573 3c2f 7469 746c 653e 0a3c 7061 7468 es.....<\n-000206f0: 6720 6964 3d22 6564 6765 3230 3722 2063 g id=\"edge207\" c\n-00020700: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-00020720: 726f 6d61 6373 5f64 6f6d 6465 6326 2334 romacs_domdec\n-00020730: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00020740: 5f67 726f 6d61 6373 5f6d 646c 6962 3c2f _gromacs_mdlib..<\n-00020820: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n-00020830: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n-00020840: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n-00020850: 3135 3434 2e36 2c2d 3635 322e 3035 2031 1544.6,-652.05 1\n-00020860: 3533 342e 3738 2c2d 3635 362e 3033 2031 534.78,-656.03 1\n-00020870: 3534 342e 3933 2c2d 3635 392e 3035 2031 544.93,-659.05 1\n-00020880: 3534 342e 362c 2d36 3532 2e30 3522 2f3e 544.6,-652.05\"/>\n-00020890: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....\n-00020900: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00020910: 6373 5f64 6f6d 6465 6326 2334 353b 2667 cs_domdec-&g\n-00020920: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00020930: 6d61 6373 5f66 696c 6569 6f3c 2f74 6974 macs_fileio</tit\n-00020940: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-00020950: 6e6f 6e65 2220 7374 726f 6b65 3d22 2362 none\" stroke=\"#b\n-00020960: 6662 6662 6622 2064 3d22 4d32 3032 302e fbfbf\" d=\"M2020.\n-00020970: 3039 2c2d 3533 322e 3333 4332 3037 392e 09,-532.33C2079.\n-00020980: 3736 2c2d 3533 322e 3434 2032 3230 302e 76,-532.44 2200.\n-00020990: 3439 2c2d 3532 362e 3632 2032 3239 302e 49,-526.62 2290.\n-000209a0: 3536 2c2d 3438 322e 3936 2032 3333 352e 56,-482.96 2335.\n-000209b0: 3539 2c2d 3436 312e 3133 2032 3337 312e 59,-461.13 2371.\n-000209c0: 3731 2c2d 3434 312e 3520 3233 3538 2e35 71,-441.5 2358.5\n-000209d0: 362c 2d33 3933 2e32 3220 3232 3937 2e39 6,-393.22 2297.9\n-000209e0: 332c 2d31 3730 2e36 3720 3231 3330 2c2d 3,-170.67 2130,-\n-000209f0: 3139 302e 3536 2031 3930 342e 3536 2c2d 190.56 1904.56,-\n-00020a00: 3134 312e 3734 2031 3831 322e 3837 2c2d 141.74 1812.87,-\n-00020a10: 3132 312e 3838 2031 3738 382e 3933 2c2d 121.88 1788.93,-\n-00020a20: 3132 322e 3138 2031 3639 362e 3536 2c2d 122.18 1696.56,-\n-00020a30: 3130 352e 3734 2031 3638 352e 3834 2c2d 105.74 1685.84,-\n-00020a40: 3130 332e 3833 2031 3637 342e 3137 2c2d 103.83 1674.17,-\n-00020a50: 3130 312e 3731 2031 3636 332e 3538 2c2d 101.71 1663.58,-\n-00020a60: 3939 2e37 3722 2f3e 0a3c 706f 6c79 676f 99.77\"/>.<polygo\n-00020a70: 6e20 6669 6c6c 3d22 2362 6662 6662 6622 n fill=\"#bfbfbf\"\n-00020a80: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n-00020a90: 2220 706f 696e 7473 3d22 3136 3633 2e38 \" points=\"1663.8\n-00020aa0: 392c 2d39 362e 3237 2031 3635 332e 3432 9,-96.27 1653.42\n-00020ab0: 2c2d 3937 2e39 3120 3136 3632 2e36 322c ,-97.91 1662.62,\n-00020ac0: 2d31 3033 2e31 3620 3136 3633 2e38 392c -103.16 1663.89,\n-00020ad0: 2d39 362e 3237 222f 3e0a 3c2f 673e 0a3c -96.27\"/>.</g>.<\n-00020ae0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-00020af0: 726f 6d61 6373 5f64 6f6d 6465 6326 2334 romacs_domdec\n-00020b00: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00020b10: 5f67 726f 6d61 6373 5f65 7761 6c64 202d _gromacs_ewald -\n-00020b20: 2d3e 0a3c 6720 6964 3d22 6564 6765 3230 ->.<g id=\"edge20\n-00020b30: 3522 2063 6c61 7373 3d22 6564 6765 223e 5\" class=\"edge\">\n-00020b40: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n-00020b50: 7263 5f67 726f 6d61 6373 5f64 6f6d 6465 rc_gromacs_domde\n-00020b60: 6326 2334 353b 2667 743b 6d6f 6475 6c65 c->module\n-00020b70: 5f73 7263 5f67 726f 6d61 6373 5f65 7761 _src_gromacs_ewa\n-00020b80: 6c64 3c2f 7469 746c 653e 0a3c 7061 7468 ld.\n-00020bf0: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 ....\n-00020ea0: 3c67 2069 643d 2265 6467 6532 3231 2220 .module_src_\n-00020ed0: 6772 6f6d 6163 735f 7461 736b 6173 7369 gromacs_taskassi\n-00020ee0: 676e 6d65 6e74 2623 3435 3b26 6774 3b6d gnment->m\n-00020ef0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-00020f00: 735f 6d64 7275 6e75 7469 6c69 7479 3c2f s_mdrunutility......module_src_grom\n-000210f0: 6163 735f 7461 736b 6173 7369 676e 6d65 acs_taskassignme\n-00021100: 6e74 2623 3435 3b26 6774 3b6d 6f64 756c nt->modul\n-00021110: 655f 7372 635f 6772 6f6d 6163 735f 6861 e_src_gromacs_ha\n-00021120: 7264 7761 7265 3c2f 7469 746c 653e 0a3c rdware.<\n-00021130: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00021140: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n-00021150: 2220 643d 224d 3138 3730 2e31 342c 2d34 \" d=\"M1870.14,-4\n-00021160: 3230 2e34 3443 3138 3539 2e36 382c 2d34 20.44C1859.68,-4\n-00021170: 3532 2e33 3720 3138 3335 2e33 2c2d 3533 52.37 1835.3,-53\n-00021180: 382e 3134 2031 3834 382e 3536 2c2d 3630 8.14 1848.56,-60\n-00021190: 382e 3720 3138 3632 2e38 2c2d 3638 342e 8.7 1862.8,-684.\n-000211a0: 3532 2031 3838 332e 372c 2d36 3938 2e35 52 1883.7,-698.5\n-000211b0: 2031 3931 312e 3536 2c2d 3737 302e 3434 1911.56,-770.44\n-000211c0: 2031 3931 382e 3531 2c2d 3738 382e 3338 1918.51,-788.38\n-000211d0: 2031 3932 362e 3335 2c2d 3830 382e 3734 1926.35,-808.74\n-000211e0: 2031 3933 322e 3132 2c2d 3832 332e 3736 1932.12,-823.76\n-000211f0: 222f 3e0a 3c70 6f6c 7967 6f6e 2066 696c \"/>....<\n-000212c0: 6720 6964 3d22 6564 6765 3232 3322 2063 g id=\"edge223\" c\n-000212d0: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-000212f0: 726f 6d61 6373 5f74 6173 6b61 7373 6967 romacs_taskassig\n-00021300: 6e6d 656e 7426 2334 353b 2667 743b 6d6f nment->mo\n-00021310: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00021320: 5f6c 6973 7465 645f 666f 7263 6573 3c2f _listed_forces....<\n-00021430: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n-00021440: 726f 6d61 6373 5f74 6173 6b61 7373 6967 romacs_taskassig\n-00021450: 6e6d 656e 7426 2334 353b 2667 743b 6d6f nment->mo\n-00021460: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00021470: 5f67 6d78 6c69 6220 2d2d 3e0a 3c67 2069 _gmxlib -->..module_src_grom\n-000214b0: 6163 735f 7461 736b 6173 7369 676e 6d65 acs_taskassignme\n-000214c0: 6e74 2623 3435 3b26 6774 3b6d 6f64 756c nt->modul\n-000214d0: 655f 7372 635f 6772 6f6d 6163 735f 676d e_src_gromacs_gm\n-000214e0: 786c 6962 3c2f 7469 746c 653e 0a3c 7061 xlib......modul\n-00021680: 655f 7372 635f 6772 6f6d 6163 735f 7461 e_src_gromacs_ta\n-00021690: 736b 6173 7369 676e 6d65 6e74 2623 3435 skassignment-\n-000216a0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f 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353b 2667 acs_ewald-&g\n+00020d80: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00020d90: 6d61 6373 5f66 6674 3c2f 7469 746c 653e macs_fft\n+00020da0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....\n+00020ea0: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module_\n+00020f10: 7372 635f 6772 6f6d 6163 735f 6577 616c src_gromacs_ewal\n+00020f20: 6426 2334 353b 2667 743b 6d6f 6475 6c65 d->module\n+00020f30: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n+00020f40: 6c69 623c 2f74 6974 6c65 3e0a 3c70 6174 lib..\n+000210a0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_src_gro\n+00021190: 6d61 6373 5f65 7761 6c64 2623 3435 3b26 macs_ewald-&\n+000211a0: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+000211b0: 6f6d 6163 735f 6d64 7479 7065 733c 2f74 omacs_mdtypes..<\n+00021320: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n+00021330: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n+00021340: 6266 6266 6266 2220 706f 696e 7473 3d22 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_domdec.\n+000215d0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .\n+000216b0: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ....module_src_gr\n+000217b0: 6f6d 6163 735f 6573 7365 6e74 6961 6c64 omacs_essentiald\n+000217c0: 796e 616d 6963 7326 2334 353b 2667 743b ynamics->\n 000217d0: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-000217e0: 6373 5f74 6173 6b61 7373 6967 6e6d 656e cs_taskassignmen\n-000217f0: 7426 2334 353b 2667 743b 6d6f 6475 6c65 t->module\n-00021800: 5f73 7263 5f67 726f 6d61 6373 5f6d 6474 _src_gromacs_mdt\n-00021810: 7970 6573 202d 2d3e 0a3c 6720 6964 3d22 ypes -->..mo\n-00021840: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00021850: 5f74 6173 6b61 7373 6967 6e6d 656e 7426 _taskassignment&\n-00021860: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00021870: 7263 5f67 726f 6d61 6373 5f6d 6474 7970 rc_gromacs_mdtyp\n-00021880: 6573 3c2f 7469 746c 653e 0a3c 7061 7468 es......modul\n-00021a10: 655f 7372 635f 6772 6f6d 6163 735f 7461 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6d6f 6475 6c65 5f73 #45;>module_s\n-00021dc0: 7263 5f67 726f 6d61 6373 5f65 7761 6c64 rc_gromacs_ewald\n-00021dd0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ..<\n-00021e70: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n-00021e80: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n-00021e90: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n-00021ea0: 3136 3337 2e38 342c 2d35 3732 2e31 3220 1637.84,-572.12 \n-00021eb0: 3136 3334 2e35 392c 2d35 3832 2e32 2031 1634.59,-582.2 1\n-00021ec0: 3634 332e 3432 2c2d 3537 362e 3335 2031 643.42,-576.35 1\n-00021ed0: 3633 372e 3834 2c2d 3537 322e 3132 222f 637.84,-572.12\"/\n-00021ee0: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >....modul\n-00022120: 655f 7372 635f 6772 6f6d 6163 735f 656e e_src_gromacs_en\n-00022130: 6572 6779 616e 616c 7973 6973 2623 3435 ergyanalysis-\n-00022140: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00022150: 6772 6f6d 6163 735f 676d 7861 6e61 3c2f gromacs_gmxana</\n-00022160: 7469 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\"edge\">.<title>m\n-00022330: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-00022340: 735f 656e 6572 6779 616e 616c 7973 6973 s_energyanalysis\n-00022350: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-00022360: 7372 635f 6772 6f6d 6163 735f 7374 6174 src_gromacs_stat\n-00022370: 6973 7469 6373 3c2f 7469 746c 653e 0a3c istics.<\n-00022380: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00022390: 2073 7472 6f6b 653d 2223 3238 3266 6363 stroke=\"#282fcc\n-000223a0: 2220 7374 726f 6b65 2d64 6173 6861 7272 \" stroke-dasharr\n-000223b0: 6179 3d22 352c 3222 2064 3d22 4d34 3936 ay=\"5,2\" d=\"M496\n-000223c0: 2e30 392c 2d33 3933 2e33 3443 3530 332e .09,-393.34C503.\n-000223d0: 3832 2c2d 3338 352e 3039 2035 3134 2e31 82,-385.09 514.1\n-000223e0: 362c 2d33 3734 2e30 3420 3532 332e 3033 6,-374.04 523.03\n-000223f0: 2c2d 3336 342e 3537 222f 3e0a 3c70 6f6c ,-364.57\"/>..\n-00022470: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...module_src_gr\n-000224f0: 6f6d 6163 735f 656e 6572 6779 616e 616c omacs_energyanal\n-00022500: 7973 6973 2623 3435 3b26 6774 3b6d 6f64 ysis->mod\n-00022510: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00022520: 6669 6c65 696f 3c2f 7469 746c 653e 0a3c fileio.<\n-00022530: 7061 7468 2066 696c 6c3d 226e 6f6e 6522 path fill=\"none\"\n-00022540: 2073 7472 6f6b 653d 2223 6266 6266 6266 stroke=\"#bfbfbf\n-00022550: 2220 643d 224d 3438 302e 3032 2c2d 3339 \" d=\"M480.02,-39\n-00022560: 332e 3136 4334 3735 2e31 382c 2d33 3737 3.16C475.18,-377\n-00022570: 2e38 3120 3436 392e 3237 2c2d 3335 312e .81 469.27,-351.\n-00022580: 3232 2034 3737 2e35 362c 2d33 3330 2e33 22 477.56,-330.3\n-00022590: 3520 3532 302e 3132 2c2d 3232 332e 3233 5 520.12,-223.23\n-000225a0: 2035 3530 2e38 392c 2d31 3930 2036 3535 550.89,-190 655\n-000225b0: 2e35 362c 2d31 3431 2e37 3420 3734 312e .56,-141.74 741.\n-000225c0: 3635 2c2d 3130 322e 3035 2031 3432 332e 65,-102.05 1423.\n-000225d0: 3138 2c2d 3934 2e37 3320 3135 3931 2e32 18,-94.73 1591.2\n-000225e0: 322c 2d39 332e 3532 222f 3e0a 3c70 6f6c 2,-93.52\"/>..\n-00022660: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...m\n-000228b0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-000228c0: 735f 636f 6d6d 616e 646c 696e 6526 2334 s_commandline\n-000228d0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-000228e0: 5f67 726f 6d61 6373 5f6f 6e6c 696e 6568 _gromacs_onlineh\n-000228f0: 656c 703c 2f74 6974 6c65 3e0a 3c70 6174 elp......mo\n-00022bf0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00022c00: 5f63 6f6d 6d61 6e64 6c69 6e65 2623 3435 _commandline-\n-00022c10: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00022c20: 6772 6f6d 6163 735f 6669 6c65 696f 3c2f gromacs_fileio</\n-00022c30: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-00022c40: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-00022c50: 2223 6266 6266 6266 2220 643d 224d 3531 \"#bfbfbf\" d=\"M51\n-00022c60: 312e 3736 2c2d 3135 302e 3334 4335 3436 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module_src_\n-00022d50: 6772 6f6d 6163 735f 746f 6f6c 7326 2334 gromacs_tools\n-00022d60: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00022d70: 5f67 726f 6d61 6373 5f72 616e 646f 6d20 _gromacs_random \n-00022d80: 2d2d 3e0a 3c67 2069 643d 2265 6467 6532 -->.<g id=\"edge2\n-00022d90: 3338 2220 636c 6173 733d 2265 6467 6522 38\" class=\"edge\"\n-00022da0: 3e0a 3c74 6974 6c65 3e6d 6f64 756c 655f >.<title>module_\n-00022db0: 7372 635f 6772 6f6d 6163 735f 746f 6f6c src_gromacs_tool\n-00022dc0: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n-00022dd0: 5f73 7263 5f67 726f 6d61 6373 5f72 616e _src_gromacs_ran\n-00022de0: 646f 6d3c 2f74 6974 6c65 3e0a 3c70 6174 dom......mo\n-00023030: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00023040: 5f74 6f6f 6c73 2623 3435 3b26 6774 3b6d _tools->m\n-00023050: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-00023060: 735f 6c69 7374 6564 5f66 6f72 6365 733c s_listed_forces<\n-00023070: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n-00023080: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n-00023090: 3d22 2332 3832 6663 6322 2073 7472 6f6b =\"#282fcc\" strok\n-000230a0: 652d 6461 7368 6172 7261 793d 2235 2c32 e-dasharray=\"5,2\n-000230b0: 2220 643d 224d 3933 372e 3331 2c2d 3130 \" d=\"M937.31,-10\n-000230c0: 3332 2e39 3243 3130 3239 2e37 2c2d 3130 32.92C1029.7,-10\n-000230d0: 3237 2e38 3720 3133 3433 2e38 342c 2d31 27.87 1343.84,-1\n-000230e0: 3030 392e 3933 2031 3630 322e 3536 2c2d 009.93 1602.56,-\n-000230f0: 3938 352e 3932 2031 3734 372e 3537 2c2d 985.92 1747.57,-\n-00023100: 3937 322e 3437 2032 3235 332e 3536 2c2d 972.47 2253.56,-\n-00023110: 3130 3536 2e32 3520 3232 3533 2e35 362c 1056.25 2253.56,\n-00023120: 2d39 3130 2e36 3220 3232 3533 2e35 362c -910.62 2253.56,\n-00023130: 2d39 3130 2e36 3220 3232 3533 2e35 362c -910.62 2253.56,\n-00023140: 2d39 3130 2e36 3220 3232 3533 2e35 362c -910.62 2253.56,\n-00023150: 2d38 3435 2e37 3520 3232 3533 2e35 362c -845.75 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6772 6f6d 6163 735f 746f 6f6c 7326 c_gromacs_tools&\n-00023250: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00023260: 7263 5f67 726f 6d61 6373 5f66 6674 202d rc_gromacs_fft -\n-00023270: 2d3e 0a3c 6720 6964 3d22 6564 6765 3234 ->.<g id=\"edge24\n-00023280: 3022 2063 6c61 7373 3d22 6564 6765 223e 0\" class=\"edge\">\n-00023290: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .<title>module_s\n-000232a0: 7263 5f67 726f 6d61 6373 5f74 6f6f 6c73 rc_gromacs_tools\n-000232b0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n-000232c0: 7372 635f 6772 6f6d 6163 735f 6666 743c src_gromacs_fft<\n-000232d0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n-000232e0: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n-000232f0: 3d22 2362 6662 6662 6622 2064 3d22 4d38 =\"#bfbfbf\" d=\"M8\n-00023300: 3834 2e31 362c 2d31 3033 322e 3338 4337 84.16,-1032.38C7\n-00023310: 3931 2e37 382c 2d31 3032 342e 3737 2034 91.78,-1024.77 4\n-00023320: 3838 2e35 362c 2d39 3933 2e34 3520 3438 88.56,-993.45 48\n-00023330: 382e 3536 2c2d 3931 302e 3632 2034 3838 8.56,-910.62 488\n-00023340: 2e35 362c 2d39 3130 2e36 3220 3438 382e .56,-910.62 488.\n-00023350: 3536 2c2d 3931 302e 3632 2034 3838 2e35 56,-910.62 488.5\n-00023360: 362c 2d37 3230 2e30 3120 3438 382e 3536 6,-720.01 488.56\n-00023370: 2c2d 3635 392e 3732 2035 3035 2e39 352c ,-659.72 505.95,\n-00023380: 2d35 3930 2e32 3320 3531 352e 3835 2c2d -590.23 515.85,-\n-00023390: 3535 352e 3533 222f 3e0a 3c70 6f6c 7967 555.53\"/>.<polyg\n-000233a0: 6f6e 2066 696c 6c3d 2223 6266 6266 6266 on fill=\"#bfbfbf\n-000233b0: 2220 7374 726f 6b65 3d22 2362 6662 6662 \" stroke=\"#bfbfb\n-000233c0: 6622 2070 6f69 6e74 733d 2235 3139 2e32 f\" points=\"519.2\n-000233d0: 312c 2d35 3536 2e35 2035 3138 2e36 362c 1,-556.5 518.66,\n-000233e0: 2d35 3435 2e39 3220 3531 322e 352c 2d35 -545.92 512.5,-5\n-000233f0: 3534 2e35 3420 3531 392e 3231 2c2d 3535 54.54 519.21,-55\n-00023400: 362e 3522 2f3e 0a3c 2f67 3e0a 3c21 2d2d 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3c21 2d2d 206d 6f64 756c ....\n-00023940: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n-00023950: 6373 5f74 6f6f 6c73 2623 3435 3b26 6774 cs_tools->\n-00023960: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n-00023970: 6163 735f 6d64 7479 7065 733c 2f74 6974 acs_mdtypes</tit\n-00023980: 6c65 3e0a 3c70 6174 6820 6669 6c6c 3d22 le>.<path fill=\"\n-00023990: 6e6f 6e65 2220 7374 726f 6b65 3d22 2362 none\" stroke=\"#b\n-000239a0: 6662 6662 6622 2064 3d22 4d39 3337 2e34 fbfbf\" d=\"M937.4\n-000239b0: 312c 2d31 3033 332e 3243 3130 3539 2e34 1,-1033.2C1059.4\n-000239c0: 312c 2d31 3032 372e 3837 2031 3535 362e 1,-1027.87 1556.\n-000239d0: 382c 2d31 3030 352e 3031 2031 3538 332e 8,-1005.01 1583.\n-000239e0: 3536 2c2d 3938 352e 3932 2031 3636 382e 56,-985.92 1668.\n-000239f0: 3334 2c2d 3932 352e 3435 2031 3632 302e 34,-925.45 1620.\n-00023a00: 3837 2c2d 3835 392e 3035 2031 3637 352e 87,-859.05 1675.\n-00023a10: 3536 2c2d 3737 302e 3434 2031 3638 312e 56,-770.44 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726f 6365 7373 202d 2d3e mxpreprocess -->\n-00023b10: 0a3c 6720 6964 3d22 6564 6765 3233 3422 .<g id=\"edge234\"\n-00023b20: 2063 6c61 7373 3d22 6564 6765 223e 0a3c class=\"edge\">.<\n-00023b30: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00023b40: 5f67 726f 6d61 6373 5f74 6f6f 6c73 2623 _gromacs_tools&#\n-00023b50: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00023b60: 635f 6772 6f6d 6163 735f 676d 7870 7265 c_gromacs_gmxpre\n-00023b70: 7072 6f63 6573 733c 2f74 6974 6c65 3e0a process.\n-00023b80: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ...\n-00023c60: 3c21 2d2d 206d 6f64 756c 655f 7372 635f .\n-00023e60: 3c67 2069 643d 2265 6467 6532 3333 2220 .module_src_\n-00023e90: 6772 6f6d 6163 735f 746f 6f6c 7326 2334 gromacs_tools\n-00023ea0: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00023eb0: 5f67 726f 6d61 6373 5f66 696c 6569 6f3c _gromacs_fileio<\n-00023ec0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>....\n-000240a0: 0a3c 6720 6964 3d22 6564 6765 3233 3222 ..<\n-000240c0: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-000240d0: 5f67 726f 6d61 6373 5f74 6f6f 6c73 2623 _gromacs_tools&#\n-000240e0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-000240f0: 635f 6772 6f6d 6163 735f 636f 6d6d 616e c_gromacs_comman\n-00024100: 646c 696e 653c 2f74 6974 6c65 3e0a 3c70 dline......module_\n-00024350: 7372 635f 6772 6f6d 6163 735f 746f 6f6c src_gromacs_tool\n-00024360: 7326 2334 353b 2667 743b 6d6f 6475 6c65 s->module\n-00024370: 5f73 7263 5f67 726f 6d61 6373 5f74 7261 _src_gromacs_tra\n-00024380: 6a65 6374 6f72 793c 2f74 6974 6c65 3e0a jectory.\n-00024390: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ....<\n-00024530: 6720 6964 3d22 6564 6765 3233 3922 2063 g id=\"edge239\" c\n-00024540: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-00024560: 726f 6d61 6373 5f74 6f6f 6c73 2623 3435 romacs_tools-\n-00024570: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n-00024580: 6772 6f6d 6163 735f 6577 616c 643c 2f74 gromacs_ewald......modu\n-00024760: 6c65 5f73 7263 5f67 726f 6d61 6373 5f63 le_src_gromacs_c\n-00024770: 6f6f 7264 696e 6174 6569 6f26 2334 353b oordinateio-\n-00024780: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-00024790: 726f 6d61 6373 5f6f 7074 696f 6e73 3c2f romacs_options</\n-000247a0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n-000247b0: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n-000247c0: 2223 3263 6363 3238 2220 7374 726f 6b65 \"#2ccc28\" stroke\n-000247d0: 2d64 6173 6861 7272 6179 3d22 352c 3222 -dasharray=\"5,2\"\n-000247e0: 2064 3d22 4d39 3233 2e39 382c 2d33 3334 d=\"M923.98,-334\n-000247f0: 2e35 3343 3933 302e 3137 2c2d 3333 332e .53C930.17,-333.\n-00024800: 3132 2039 3336 2e35 352c 2d33 3331 2e36 12 936.55,-331.6\n-00024810: 3820 3934 322e 3536 2c2d 3333 302e 3335 8 942.56,-330.35\n-00024820: 2031 3135 322e 3837 2c2d 3238 332e 3932 1152.87,-283.92\n-00024830: 2031 3535 332e 372c 2d33 3635 2e35 3420 1553.7,-365.54 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6163 735f 676d 786c 6962 c_gromacs_gmxlib\n-00024930: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n-00024940: 3234 3622 2063 6c61 7373 3d22 6564 6765 246\" class=\"edge\n-00024950: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n-00024960: 5f73 7263 5f67 726f 6d61 6373 5f72 6573 _src_gromacs_res\n-00024970: 7472 6169 6e74 2623 3435 3b26 6774 3b6d traint->m\n-00024980: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n-00024990: 735f 676d 786c 6962 3c2f 7469 746c 653e s_gmxlib\n-000249a0: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ...<\n-00024ab0: 2f67 3e0a 3c21 2d2d 206d 6f64 756c 655f /g>...module_src_gro\n-00024b30: 6d61 6373 5f72 6573 7472 6169 6e74 2623 macs_restraint&#\n-00024b40: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00024b50: 635f 6772 6f6d 6163 735f 6d64 7479 7065 c_gromacs_mdtype\n-00024b60: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s..\n-00024c70: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module_src_gr\n-00024cf0: 6f6d 6163 735f 7265 7374 7261 696e 7426 omacs_restraint&\n-00024d00: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n-00024d10: 7263 5f67 726f 6d61 6373 5f64 6f6d 6465 rc_gromacs_domde\n-00024d20: 633c 2f74 6974 6c65 3e0a 3c70 6174 6820 c....\n-00024e20: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..modu\n-00024e90: 6c65 5f73 7263 5f67 726f 6d61 6373 5f65 le_src_gromacs_e\n-00024ea0: 7761 6c64 2623 3435 3b26 6774 3b6d 6f64 wald->mod\n-00024eb0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00024ec0: 6770 755f 7574 696c 733c 2f74 6974 6c65 gpu_utils</title\n-00024ed0: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n-00024ee0: 6e65 2220 7374 726f 6b65 3d22 7265 6422 ne\" stroke=\"red\"\n-00024ef0: 2064 3d22 4d31 3633 392e 3438 2c2d 3630 d=\"M1639.48,-60\n-00024f00: 372e 3233 4331 3637 382e 3832 2c2d 3633 7.23C1678.82,-63\n-00024f10: 382e 3220 3137 3931 2e31 322c 2d37 3236 8.2 1791.12,-726\n-00024f20: 2e36 3320 3138 3339 2e37 2c2d 3736 342e .63 1839.7,-764.\n-00024f30: 3838 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6f6d >module_src_grom\n-00025020: 6163 735f 6577 616c 6426 2334 353b 2667 acs_ewald-&g\n-00025030: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00025040: 6d61 6373 5f68 6172 6477 6172 653c 2f74 macs_hardware</t\n-00025050: 6974 6c65 3e0a 3c70 6174 6820 6669 6c6c itle>.<path fill\n-00025060: 3d22 6e6f 6e65 2220 7374 726f 6b65 3d22 =\"none\" stroke=\"\n-00025070: 7265 6422 2064 3d22 4d31 3632 312e 3837 red\" d=\"M1621.87\n-00025080: 2c2d 3630 382e 3637 4331 3631 322e 3335 ,-608.67C1612.35\n-00025090: 2c2d 3634 332e 3537 2031 3539 302e 3935 ,-643.57 1590.95\n-000250a0: 2c2d 3734 332e 3535 2031 3634 302e 3536 ,-743.55 1640.56\n-000250b0: 2c2d 3739 372e 3331 2031 3637 352e 382c ,-797.31 1675.8,\n-000250c0: 2d38 3335 2e34 3920 3138 3230 2e33 332c -835.49 1820.33,\n-000250d0: 2d38 3234 2e37 2031 3837 312e 3536 2c2d -824.7 1871.56,-\n-000250e0: 3833 332e 3331 2031 3837 392e 3735 2c2d 833.31 1879.75,-\n-000250f0: 3833 342e 3639 2031 3838 382e 3438 2c2d 834.69 1888.48,-\n-00025100: 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6974 6c65 s=\"edge\">.<title\n-000251f0: 3e6d 6f64 756c 655f 7372 635f 6772 6f6d >module_src_grom\n-00025200: 6163 735f 6577 616c 6426 2334 353b 2667 acs_ewald-&g\n-00025210: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00025220: 6d61 6373 5f6e 626e 786d 3c2f 7469 746c macs_nbnxm</titl\n-00025230: 653e 0a3c 7061 7468 2066 696c 6c3d 226e e>.<path fill=\"n\n-00025240: 6f6e 6522 2073 7472 6f6b 653d 2223 3238 one\" stroke=\"#28\n-00025250: 3266 6363 2220 7374 726f 6b65 2d64 6173 2fcc\" stroke-das\n-00025260: 6861 7272 6179 3d22 352c 3222 2064 3d22 harray=\"5,2\" d=\"\n-00025270: 4d31 3634 382e 372c 2d35 3837 2e30 3943 M1648.7,-587.09C\n-00025280: 3137 3036 2e35 312c 2d35 3639 2e36 3320 1706.51,-569.63 \n-00025290: 3138 3537 2e30 362c 2d35 3138 2e39 2031 1857.06,-518.9 1\n-000252a0: 3933 352e 3536 2c2d 3432 302e 3039 2031 935.56,-420.09 1\n-000252b0: 3936 312e 3331 2c2d 3338 372e 3637 2031 961.31,-387.67 1\n-000252c0: 3933 352e 3533 2c2d 3336 332e 3333 2031 935.53,-363.33 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7372 635f 6772 6f6d ;module_src_grom\n-000253c0: 6163 735f 6666 7420 2d2d 3e0a 3c67 2069 acs_fft -->.<g i\n-000253d0: 643d 2265 6467 6532 3439 2220 636c 6173 d=\"edge249\" clas\n-000253e0: 733d 2265 6467 6522 3e0a 3c74 6974 6c65 s=\"edge\">.<title\n-000253f0: 3e6d 6f64 756c 655f 7372 635f 6772 6f6d >module_src_grom\n-00025400: 6163 735f 6577 616c 6426 2334 353b 2667 acs_ewald-&g\n-00025410: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00025420: 6d61 6373 5f66 6674 3c2f 7469 746c 653e macs_fft\n-00025430: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ....\n-00025500: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module_\n-00025570: 7372 635f 6772 6f6d 6163 735f 6577 616c src_gromacs_ewal\n-00025580: 6426 2334 353b 2667 743b 6d6f 6475 6c65 d->module\n-00025590: 5f73 7263 5f67 726f 6d61 6373 5f67 6d78 _src_gromacs_gmx\n-000255a0: 6c69 623c 2f74 6974 6c65 3e0a 3c70 6174 lib....\n-00025760: 0a3c 6720 6964 3d22 6564 6765 3235 3322 ..<\n-00025780: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n-00025790: 5f67 726f 6d61 6373 5f65 7761 6c64 2623 _gromacs_ewald&#\n-000257a0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-000257b0: 635f 6772 6f6d 6163 735f 6d64 7479 7065 c_gromacs_mdtype\n-000257c0: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s.....\n-00025920: 3c67 2069 643d 2265 6467 6532 3532 2220 .module_src_\n-00025950: 6772 6f6d 6163 735f 6577 616c 6426 2334 gromacs_ewald\n-00025960: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n-00025970: 5f67 726f 6d61 6373 5f6d 646c 6962 3c2f _gromacs_mdlib..<\n-000259f0: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n-00025a00: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n-00025a10: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n-00025a20: 3135 3334 2e39 372c 2d36 3431 2e35 3220 1534.97,-641.52 \n-00025a30: 3135 3237 2e34 2c2d 3634 382e 3933 2031 1527.4,-648.93 1\n-00025a40: 3533 372e 3934 2c2d 3634 372e 3836 2031 537.94,-647.86 1\n-00025a50: 3533 342e 3937 2c2d 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6d69 6d69 6326 2334 353b omacs_mimic-\n-00025c90: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-00025ca0: 726f 6d61 6373 5f6d 646c 6962 3c2f 7469 romacs_mdlib</ti\n-00025cb0: 746c 653e 0a3c 7061 7468 2066 696c 6c3d tle>.<path fill=\n-00025cc0: 226e 6f6e 6522 2073 7472 6f6b 653d 2223 \"none\" stroke=\"#\n-00025cd0: 3238 3266 6363 2220 7374 726f 6b65 2d64 282fcc\" stroke-d\n-00025ce0: 6173 6861 7272 6179 3d22 352c 3222 2064 asharray=\"5,2\" d\n-00025cf0: 3d22 4d31 3635 392e 3034 2c2d 3432 302e =\"M1659.04,-420.\n-00025d00: 3034 4331 3637 332e 3134 2c2d 3435 342e 04C1673.14,-454.\n-00025d10: 3035 2031 3730 362e 3732 2c2d 3535 302e 05 1706.72,-550.\n-00025d20: 3231 2031 3636 332e 3536 2c2d 3630 382e 21 1663.56,-608.\n-00025d30: 3720 3136 3336 2e35 382c 2d36 3435 2e32 7 1636.58,-645.2\n-00025d40: 3620 3135 3832 2e34 2c2d 3635 352e 3037 6 1582.4,-655.07\n-00025d50: 2031 3534 352e 3331 2c2d 3635 372e 3237 1545.31,-657.27\n-00025d60: 222f 3e0a 3c70 6f6c 7967 6f6e 2066 696c 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2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n-00025f40: 726f 6d61 6373 5f67 7075 5f75 7469 6c73 romacs_gpu_utils\n-00025f50: 202d 2d3e 0a3c 6720 6964 3d22 6564 6765 -->.<g id=\"edge\n-00025f60: 3235 3722 2063 6c61 7373 3d22 6564 6765 257\" class=\"edge\n-00025f70: 223e 0a3c 7469 746c 653e 6d6f 6475 6c65 \">.<title>module\n-00025f80: 5f73 7263 5f67 726f 6d61 6373 5f70 6263 _src_gromacs_pbc\n-00025f90: 7574 696c 2623 3435 3b26 6774 3b6d 6f64 util->mod\n-00025fa0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n-00025fb0: 6770 755f 7574 696c 733c 2f74 6974 6c65 gpu_utils</title\n-00025fc0: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n-00025fd0: 6e65 2220 7374 726f 6b65 3d22 2362 6662 ne\" stroke=\"#bfb\n-00025fe0: 6662 6622 2064 3d22 4d31 3833 372e 3034 fbf\" d=\"M1837.04\n-00025ff0: 2c2d 3833 332e 3433 4331 3834 312e 3136 ,-833.43C1841.16\n-00026000: 2c2d 3832 352e 3539 2031 3834 362e 362c ,-825.59 1846.6,\n-00026010: 2d38 3135 2e32 3320 3138 3531 2e34 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7070 6c69 6564 5f66 6f72 6365 735f 6177 pplied_forces_aw\n-000262d0: 6826 2334 353b 2667 743b 6d6f 6475 6c65 h->module\n-000262e0: 5f73 7263 5f67 726f 6d61 6373 5f6d 6472 _src_gromacs_mdr\n-000262f0: 756e 7574 696c 6974 793c 2f74 6974 6c65 unutility</title\n-00026300: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n-00026310: 6e65 2220 7374 726f 6b65 3d22 2332 3832 ne\" stroke=\"#282\n-00026320: 6663 6322 2073 7472 6f6b 652d 6461 7368 fcc\" stroke-dash\n-00026330: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n-00026340: 3131 3331 2e39 352c 2d34 3230 2e33 3343 1131.95,-420.33C\n-00026350: 3131 3232 2e36 392c 2d34 3636 2e35 2031 1122.69,-466.5 1\n-00026360: 3039 322e 3934 2c2d 3632 352e 3436 2031 092.94,-625.46 1\n-00026370: 3131 322e 3536 2c2d 3637 312e 3537 2031 112.56,-671.57 1\n-00026380: 3135 392e 3839 2c2d 3738 322e 3831 2031 159.89,-782.81 1\n-00026390: 3230 332e 3831 2c2d 3739 392e 3833 2031 203.81,-799.83 1\n-000263a0: 3330 382e 3536 2c2d 3836 302e 3138 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706f 6c79 676f 21.34\"/>.....module_\n-00026ab0: 7372 635f 6772 6f6d 6163 735f 6170 706c src_gromacs_appl\n-00026ac0: 6965 645f 666f 7263 6573 5f61 7768 2623 ied_forces_awh&#\n-00026ad0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n-00026ae0: 635f 6772 6f6d 6163 735f 6d64 7479 7065 c_gromacs_mdtype\n-00026af0: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s..<\n-00026b90: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n-00026ba0: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n-00026bb0: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n-00026bc0: 3136 3730 2e30 312c 2d37 3138 2e39 3420 1670.01,-718.94 \n-00026bd0: 3136 3830 2e33 312c 2d37 3136 2e34 3620 1680.31,-716.46 \n-00026be0: 3136 3730 2e37 312c 2d37 3131 2e39 3820 1670.71,-711.98 \n-00026bf0: 3136 3730 2e30 312c 2d37 3138 2e39 3422 1670.01,-718.94\"\n-00026c00: 2f3e 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 />....mo\n-00026c80: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n-00026c90: 5f61 7070 6c69 6564 5f66 6f72 6365 735f _applied_forces_\n-00026ca0: 6177 6826 2334 353b 2667 743b 6d6f 6475 awh->modu\n-00026cb0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f66 le_src_gromacs_f\n-00026cc0: 696c 6569 6f3c 2f74 6974 6c65 3e0a 3c70 ileio.....<\n-00026e60: 6720 6964 3d22 6564 6765 3236 3822 2063 g id=\"edge268\" c\n-00026e70: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n-00026e90: 726f 6d61 6373 5f61 7070 6c69 6564 5f66 romacs_applied_f\n-00026ea0: 6f72 6365 735f 6177 6826 2334 353b 2667 orces_awh-&g\n-00026eb0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n-00026ec0: 6d61 6373 5f74 7261 6a65 6374 6f72 793c macs_trajectory<\n-00026ed0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>......\n+000217e0: 6373 5f6d 6472 756e 7574 696c 6974 793c cs_mdrunutility<\n+000217f0: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>......m\n+00021a60: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00021a70: 735f 6573 7365 6e74 6961 6c64 796e 616d s_essentialdynam\n+00021a80: 6963 7326 2334 353b 2667 743b 6d6f 6475 ics->modu\n+00021a90: 6c65 5f73 7263 5f67 726f 6d61 6373 5f67 le_src_gromacs_g\n+00021aa0: 6d78 6c69 623c 2f74 6974 6c65 3e0a 3c70 mxlib....<\n+00021c20: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+00021c30: 726f 6d61 6373 5f65 7373 656e 7469 616c romacs_essential\n+00021c40: 6479 6e61 6d69 6373 2623 3435 3b26 6774 dynamics->\n+00021c50: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+00021c60: 6163 735f 6d64 7479 7065 7320 2d2d 3e0a acs_mdtypes -->.\n+00021c70: 3c67 2069 643d 2265 6467 6532 3331 2220 .module_src_\n+00021ca0: 6772 6f6d 6163 735f 6573 7365 6e74 6961 gromacs_essentia\n+00021cb0: 6c64 796e 616d 6963 7326 2334 353b 2667 ldynamics-&g\n+00021cc0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00021cd0: 6d61 6373 5f6d 6474 7970 6573 3c2f 7469 macs_mdtypes..\n+00021e50: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....module\n+00021ed0: 5f73 7263 5f67 726f 6d61 6373 5f65 7373 _src_gromacs_ess\n+00021ee0: 656e 7469 616c 6479 6e61 6d69 6373 2623 entialdynamics&#\n+00021ef0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+00021f00: 635f 6772 6f6d 6163 735f 6d64 6c69 623c c_gromacs_mdlib<\n+00021f10: 2f74 6974 6c65 3e0a 3c70 6174 6820 6669 /title>.<path fi\n+00021f20: 6c6c 3d22 6e6f 6e65 2220 7374 726f 6b65 ll=\"none\" stroke\n+00021f30: 3d22 2362 6662 6662 6622 2064 3d22 4d32 =\"#bfbfbf\" d=\"M2\n+00021f40: 3435 312e 3636 2c2d 3136 342e 3136 4332 451.66,-164.16C2\n+00021f50: 3433 382e 3031 2c2d 3136 352e 3820 3234 438.01,-165.8 24\n+00021f60: 3233 2e32 392c 2d31 3637 2e34 2032 3430 23.29,-167.4 240\n+00021f70: 392e 3536 2c2d 3136 382e 3631 2032 3038 9.56,-168.61 208\n+00021f80: 372e 3039 2c2d 3139 372e 3036 2031 3639 7.09,-197.06 169\n+00021f90: 352e 352c 2d32 3131 2e38 3920 3135 3732 5.5,-211.89 1572\n+00021fa0: 2e39 362c 2d32 3135 2e39 222f 3e0a 3c70 .96,-215.9\"/>.<p\n+00021fb0: 6f6c 7967 6f6e 2066 696c 6c3d 2223 6266 olygon fill=\"#bf\n+00021fc0: 6266 6266 2220 7374 726f 6b65 3d22 2362 bfbf\" stroke=\"#b\n+00021fd0: 6662 6662 6622 2070 6f69 6e74 733d 2231 fbfbf\" points=\"1\n+00021fe0: 3537 322e 3832 2c2d 3231 322e 3431 2031 572.82,-212.41 1\n+00021ff0: 3536 322e 3934 2c2d 3231 362e 3233 2031 562.94,-216.23 1\n+00022000: 3537 332e 3035 2c2d 3231 392e 3420 3135 573.05,-219.4 15\n+00022010: 3732 2e38 322c 2d32 3132 2e34 3122 2f3e 72.82,-212.41\"/>\n+00022020: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c .</g>.<!-- modul\n+00022030: 655f 7372 635f 6772 6f6d 6163 735f 6573 e_src_gromacs_es\n+00022040: 7365 6e74 6961 6c64 796e 616d 6963 7326 sentialdynamics&\n+00022050: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00022060: 7263 5f67 726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n+00022070: 6f20 2d2d 3e0a 3c67 2069 643d 2265 6467 o -->.<g id=\"edg\n+00022080: 6532 3237 2220 636c 6173 733d 2265 6467 e227\" class=\"edg\n+00022090: 6522 3e0a 3c74 6974 6c65 3e6d 6f64 756c e\">.<title>modul\n+000220a0: 655f 7372 635f 6772 6f6d 6163 735f 6573 e_src_gromacs_es\n+000220b0: 7365 6e74 6961 6c64 796e 616d 6963 7326 sentialdynamics&\n+000220c0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+000220d0: 7263 5f67 726f 6d61 6373 5f66 696c 6569 rc_gromacs_filei\n+000220e0: 6f3c 2f74 6974 6c65 3e0a 3c70 6174 6820 o.\n+000221b0: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 .....m\n+000222a0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+000222b0: 735f 6573 7365 6e74 6961 6c64 796e 616d s_essentialdynam\n+000222c0: 6963 7326 2334 353b 2667 743b 6d6f 6475 ics->modu\n+000222d0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f64 le_src_gromacs_d\n+000222e0: 6f6d 6465 633c 2f74 6974 6c65 3e0a 3c70 omdec......module_src_grom\n+000224a0: 6163 735f 6573 7365 6e74 6961 6c64 796e acs_essentialdyn\n+000224b0: 616d 6963 7326 2334 353b 2667 743b 6d6f amics->mo\n+000224c0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000224d0: 5f63 6f6d 6d61 6e64 6c69 6e65 3c2f 7469 _commandline..\n+00022600: 0a3c 2f67 3e0a 3c21 2d2d 206d 6f64 756c ....mo\n+00022670: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00022680: 5f6d 6174 6826 2334 353b 2667 743b 6d6f _math->mo\n+00022690: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000226a0: 5f6d 6473 7061 6e3c 2f74 6974 6c65 3e0a _mdspan.\n+000226b0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ....\n+000227c0: 0a3c 7469 746c 653e 6d6f 6475 6c65 5f73 .module_s\n+000227d0: 7263 5f67 726f 6d61 6373 5f73 696d 643c rc_gromacs_simd<\n+000227e0: 2f74 6974 6c65 3e0a 3c67 2069 643d 2261 /title>.<g id=\"a\n+000227f0: 5f6e 6f64 6534 3422 3e3c 6120 786c 696e _node44\"><a xlin\n+00022800: 6b3a 6872 6566 3d22 6772 6f75 705f 5f6d k:href=\"group__m\n+00022810: 6f64 756c 655f 5f73 696d 642e 7868 746d odule__simd.xhtm\n+00022820: 6c22 2074 6172 6765 743d 225f 746f 7022 l\" target=\"_top\"\n+00022830: 2078 6c69 6e6b 3a74 6974 6c65 3d22 7369 xlink:title=\"si\n+00022840: 6d64 223e 0a3c 656c 6c69 7073 6520 6669 md\">.<ellipse fi\n+00022850: 6c6c 3d22 2366 6665 3463 6322 2073 7472 ll=\"#ffe4cc\" str\n+00022860: 6f6b 653d 2262 6c61 636b 2220 6378 3d22 oke=\"black\" cx=\"\n+00022870: 3537 382e 3536 2220 6379 3d22 2d31 3232 578.56\" cy=\"-122\n+00022880: 332e 3937 2220 7278 3d22 3237 2220 7279 3.97\" rx=\"27\" ry\n+00022890: 3d22 3133 2e33 3722 2f3e 0a3c 7465 7874 =\"13.37\"/>.<text\n+000228a0: 2074 6578 742d 616e 6368 6f72 3d22 6d69 text-anchor=\"mi\n+000228b0: 6464 6c65 2220 783d 2235 3738 2e35 3622 ddle\" x=\"578.56\"\n+000228c0: 2079 3d22 2d31 3232 312e 3437 2220 666f y=\"-1221.47\" fo\n+000228d0: 6e74 2d66 616d 696c 793d 2246 7265 6553 nt-family=\"FreeS\n+000228e0: 616e 7322 2066 6f6e 742d 7369 7a65 3d22 ans\" font-size=\"\n+000228f0: 3130 2e30 3022 3e73 696d 643c 2f74 6578 10.00\">simd</tex\n+00022900: 743e 0a3c 2f61 3e0a 3c2f 673e 0a3c 2f67 t>.</a>.</g>.</g\n+00022910: 3e0a 3c21 2d2d 206d 6f64 756c 655f 7372 >.<!-- module_sr\n+00022920: 635f 6772 6f6d 6163 735f 6d6f 6475 6c61 c_gromacs_modula\n+00022930: 7273 696d 756c 6174 6f72 2623 3435 3b26 rsimulator-&\n+00022940: 6774 3b6d 6f64 756c 655f 7372 635f 6772 gt;module_src_gr\n+00022950: 6f6d 6163 735f 6d64 7275 6e75 7469 6c69 omacs_mdrunutili\n+00022960: 7479 202d 2d3e 0a3c 6720 6964 3d22 6564 ty -->.<g id=\"ed\n+00022970: 6765 3234 3022 2063 6c61 7373 3d22 6564 ge240\" class=\"ed\n+00022980: 6765 223e 0a3c 7469 746c 653e 6d6f 6475 ge\">.<title>modu\n+00022990: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+000229a0: 6f64 756c 6172 7369 6d75 6c61 746f 7226 odularsimulator&\n+000229b0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+000229c0: 7263 5f67 726f 6d61 6373 5f6d 6472 756e rc_gromacs_mdrun\n+000229d0: 7574 696c 6974 793c 2f74 6974 6c65 3e0a utility.\n+000229e0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ...<\n+00022bd0: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+00022be0: 726f 6d61 6373 5f6d 6f64 756c 6172 7369 romacs_modularsi\n+00022bf0: 6d75 6c61 746f 7226 2334 353b 2667 743b mulator->\n+00022c00: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00022c10: 6373 5f72 616e 646f 6d20 2d2d 3e0a 3c67 cs_random -->..module_src_gr\n+00022c50: 6f6d 6163 735f 6d6f 6475 6c61 7273 696d omacs_modularsim\n+00022c60: 756c 6174 6f72 2623 3435 3b26 6774 3b6d ulator->m\n+00022c70: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00022c80: 735f 7261 6e64 6f6d 3c2f 7469 746c 653e s_random\n+00022c90: 0a3c 7061 7468 2066 696c 6c3d 226e 6f6e ......m\n+00022e80: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00022e90: 735f 6d6f 6475 6c61 7273 696d 756c 6174 s_modularsimulat\n+00022ea0: 6f72 2623 3435 3b26 6774 3b6d 6f64 756c or->modul\n+00022eb0: 655f 7372 635f 6772 6f6d 6163 735f 6770 e_src_gromacs_gp\n+00022ec0: 755f 7574 696c 733c 2f74 6974 6c65 3e0a u_utils.\n+00022ed0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 .....mod\n+000230d0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000230e0: 6d6f 6475 6c61 7273 696d 756c 6174 6f72 modularsimulator\n+000230f0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+00023100: 7372 635f 6772 6f6d 6163 735f 6c69 7374 src_gromacs_list\n+00023110: 6564 5f66 6f72 6365 733c 2f74 6974 6c65 ed_forces</title\n+00023120: 3e0a 3c70 6174 6820 6669 6c6c 3d22 6e6f >.<path fill=\"no\n+00023130: 6e65 2220 7374 726f 6b65 3d22 2332 3832 ne\" stroke=\"#282\n+00023140: 6663 6322 2073 7472 6f6b 652d 6461 7368 fcc\" stroke-dash\n+00023150: 6172 7261 793d 2235 2c32 2220 643d 224d array=\"5,2\" d=\"M\n+00023160: 3138 3335 2e35 332c 2d35 3833 2e34 3143 1835.53,-583.41C\n+00023170: 3138 3736 2e32 342c 2d35 3637 2e35 3820 1876.24,-567.58 \n+00023180: 3139 3437 2e33 322c 2d35 3334 2e33 3420 1947.32,-534.34 \n+00023190: 3139 3837 2e35 362c 2d34 3832 2e39 3620 1987.56,-482.96 \n+000231a0: 3230 3237 2e35 362c 2d34 3331 2e38 3920 2027.56,-431.89 \n+000231b0: 3230 3335 2e36 312c 2d32 3535 2e37 3220 2035.61,-255.72 \n+000231c0: 3230 3735 2e35 362c 2d32 3034 2e36 3120 2075.56,-204.61 \n+000231d0: 3230 3836 2e37 322c 2d31 3930 2e33 3420 2086.72,-190.34 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3138 222f 3e0a 3c2f 673e 0a3c 212d 2d20 18\"/>.</g>.<!-- \n+00023670: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00023680: 6373 5f6d 6f64 756c 6172 7369 6d75 6c61 cs_modularsimula\n+00023690: 746f 7226 2334 353b 2667 743b 6d6f 6475 tor->modu\n+000236a0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+000236b0: 6472 756e 202d 2d3e 0a3c 6720 6964 3d22 drun -->.<g id=\"\n+000236c0: 6564 6765 3233 3922 2063 6c61 7373 3d22 edge239\" class=\"\n+000236d0: 6564 6765 223e 0a3c 7469 746c 653e 6d6f edge\">.<title>mo\n+000236e0: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+000236f0: 5f6d 6f64 756c 6172 7369 6d75 6c61 746f _modularsimulato\n+00023700: 7226 2334 353b 2667 743b 6d6f 6475 6c65 r->module\n+00023710: 5f73 7263 5f67 726f 6d61 6373 5f6d 6472 _src_gromacs_mdr\n+00023720: 756e 3c2f 7469 746c 653e 0a3c 7061 7468 un..\n+00023790: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2272 .\n+00023800: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ..\n+00023850: 3c67 2069 643d 2265 6467 6532 3336 2220 .module_src_\n+00023880: 6772 6f6d 6163 735f 6d6f 6475 6c61 7273 gromacs_modulars\n+00023890: 696d 756c 6174 6f72 2623 3435 3b26 6774 imulator->\n+000238a0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+000238b0: 6163 735f 676d 786c 6962 3c2f 7469 746c acs_gmxlib....\n+00023a50: 0a3c 6720 6964 3d22 6564 6765 3234 3322 ..<\n+00023a70: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+00023a80: 5f67 726f 6d61 6373 5f6d 6f64 756c 6172 _gromacs_modular\n+00023a90: 7369 6d75 6c61 746f 7226 2334 353b 2667 simulator-&g\n+00023aa0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00023ab0: 6d61 6373 5f63 6f6d 7061 743c 2f74 6974 macs_compat......mo\n+00023c90: 6475 6c65 5f73 7263 5f67 726f 6d61 6373 dule_src_gromacs\n+00023ca0: 5f6d 6f64 756c 6172 7369 6d75 6c61 746f _modularsimulato\n+00023cb0: 7226 2334 353b 2667 743b 6d6f 6475 6c65 r->module\n+00023cc0: 5f73 7263 5f67 726f 6d61 6373 5f6d 6474 _src_gromacs_mdt\n+00023cd0: 7970 6573 3c2f 7469 746c 653e 0a3c 7061 ypes.\n+00023da0: 0a3c 706f 6c79 676f 6e20 6669 6c6c 3d22 ...\n+00023e10: 3c21 2d2d 206d 6f64 756c 655f 7372 635f ..module_src_gr\n+00023e90: 6f6d 6163 735f 6d6f 6475 6c61 7273 696d omacs_modularsim\n+00023ea0: 756c 6174 6f72 2623 3435 3b26 6774 3b6d ulator->m\n+00023eb0: 6f64 756c 655f 7372 635f 6772 6f6d 6163 odule_src_gromac\n+00023ec0: 735f 6d64 6c69 623c 2f74 6974 6c65 3e0a s_mdlib.\n+00023ed0: 3c70 6174 6820 6669 6c6c 3d22 6e6f 6e65 ..\n+00024030: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...module_\n+000240b0: 7372 635f 6772 6f6d 6163 735f 6d6f 6475 src_gromacs_modu\n+000240c0: 6c61 7273 696d 756c 6174 6f72 2623 3435 larsimulator-\n+000240d0: 3b26 6774 3b6d 6f64 756c 655f 7372 635f ;>module_src_\n+000240e0: 6772 6f6d 6163 735f 6669 6c65 696f 3c2f gromacs_fileio</\n+000240f0: 7469 746c 653e 0a3c 7061 7468 2066 696c title>.<path fil\n+00024100: 6c3d 226e 6f6e 6522 2073 7472 6f6b 653d l=\"none\" stroke=\n+00024110: 2223 6266 6266 6266 2220 643d 224d 3137 \"#bfbfbf\" d=\"M17\n+00024120: 3535 2e32 362c 2d36 3034 2e30 3743 3137 55.26,-604.07C17\n+00024130: 3432 2e30 382c 2d36 3035 2e37 3420 3137 42.08,-605.74 17\n+00024140: 3237 2e38 332c 2d36 3037 2e33 3920 3137 27.83,-607.39 17\n+00024150: 3134 2e35 362c 2d36 3038 2e37 2031 3437 14.56,-608.7 147\n+00024160: 312e 3537 2c2d 3633 322e 3737 2031 3137 1.57,-632.77 117\n+00024170: 372e 3637 2c2d 3634 392e 3938 2031 3037 7.67,-649.98 107\n+00024180: 352e 3531 2c2d 3635 352e 3336 222f 3e0a 5.51,-655.36\"/>.\n+00024190: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 <polygon fill=\"#\n+000241a0: 6266 6266 6266 2220 7374 726f 6b65 3d22 bfbfbf\" stroke=\"\n+000241b0: 2362 6662 6662 6622 2070 6f69 6e74 733d #bfbfbf\" points=\n+000241c0: 2231 3037 352e 322c 2d36 3531 2e38 3720 \"1075.2,-651.87 \n+000241d0: 3130 3635 2e33 392c 2d36 3535 2e38 3820 1065.39,-655.88 \n+000241e0: 3130 3735 2e35 362c 2d36 3538 2e38 3620 1075.56,-658.86 \n+000241f0: 3130 3735 2e32 2c2d 3635 312e 3837 222f 1075.2,-651.87\"/\n+00024200: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >.</g>.<!-- modu\n+00024210: 6c65 5f73 7263 5f67 726f 6d61 6373 5f6d le_src_gromacs_m\n+00024220: 6f64 756c 6172 7369 6d75 6c61 746f 7226 odularsimulator&\n+00024230: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00024240: 7263 5f67 726f 6d61 6373 5f64 6f6d 6465 rc_gromacs_domde\n+00024250: 6320 2d2d 3e0a 3c67 2069 643d 2265 6467 c -->.<g id=\"edg\n+00024260: 6532 3334 2220 636c 6173 733d 2265 6467 e234\" class=\"edg\n+00024270: 6522 3e0a 3c74 6974 6c65 3e6d 6f64 756c e\">.<title>modul\n+00024280: 655f 7372 635f 6772 6f6d 6163 735f 6d6f e_src_gromacs_mo\n+00024290: 6475 6c61 7273 696d 756c 6174 6f72 2623 dularsimulator&#\n+000242a0: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+000242b0: 635f 6772 6f6d 6163 735f 646f 6d64 6563 c_gromacs_domdec\n+000242c0: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 .....<\n+00024420: 6720 6964 3d22 6564 6765 3233 3322 2063 g id=\"edge233\" c\n+00024430: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+00024450: 726f 6d61 6373 5f6d 6f64 756c 6172 7369 romacs_modularsi\n+00024460: 6d75 6c61 746f 7226 2334 353b 2667 743b mulator->\n+00024470: 6d6f 6475 6c65 5f73 7263 5f67 726f 6d61 module_src_groma\n+00024480: 6373 5f63 6f6d 6d61 6e64 6c69 6e65 3c2f cs_commandline...\n+000245e0: 3c2f 673e 0a3c 212d 2d20 6d6f 6475 6c65 ...module\n+00024850: 5f73 7263 5f67 726f 6d61 6373 5f6d 6f64 _src_gromacs_mod\n+00024860: 756c 6172 7369 6d75 6c61 746f 7226 2334 ularsimulator\n+00024870: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+00024880: 5f67 726f 6d61 6373 5f70 756c 6c69 6e67 _gromacs_pulling\n+00024890: 3c2f 7469 746c 653e 0a3c 7061 7468 2066 ......module_src_gr\n+00024a10: 6f6d 6163 735f 7075 6c6c 696e 6726 2334 omacs_pulling\n+00024a20: 353b 2667 743b 6d6f 6475 6c65 5f73 7263 5;>module_src\n+00024a30: 5f67 726f 6d61 6373 5f6d 6472 756e 7574 _gromacs_mdrunut\n+00024a40: 696c 6974 793c 2f74 6974 6c65 3e0a 3c70 ility.....\n+00024c50: 3c67 2069 643d 2265 6467 6532 3439 2220 .module_src_\n+00024c80: 6772 6f6d 6163 735f 7075 6c6c 696e 6726 gromacs_pulling&\n+00024c90: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00024ca0: 7263 5f67 726f 6d61 6373 5f67 6d78 6c69 rc_gromacs_gmxli\n+00024cb0: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b..\n+00024d80: 3c70 6f6c 7967 6f6e 2066 696c 6c3d 2223 ...<\n+00024e40: 6720 6964 3d22 6564 6765 3235 3022 2063 g id=\"edge250\" c\n+00024e50: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+00024e70: 726f 6d61 6373 5f70 756c 6c69 6e67 2623 romacs_pulling&#\n+00024e80: 3435 3b26 6774 3b6d 6f64 756c 655f 7372 45;>module_sr\n+00024e90: 635f 6772 6f6d 6163 735f 6d64 7479 7065 c_gromacs_mdtype\n+00024ea0: 733c 2f74 6974 6c65 3e0a 3c70 6174 6820 s....\n+00025060: 0a3c 6720 6964 3d22 6564 6765 3235 3522 ..<\n+00025080: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+00025090: 5f67 726f 6d61 6373 5f70 756c 6c69 6e67 _gromacs_pulling\n+000250a0: 2623 3435 3b26 6774 3b6d 6f64 756c 655f ->module_\n+000250b0: 7372 635f 6772 6f6d 6163 735f 6d64 6c69 src_gromacs_mdli\n+000250c0: 623c 2f74 6974 6c65 3e0a 3c70 6174 6820 b......module_\n+00025470: 7372 635f 6772 6f6d 6163 735f 7075 6c6c src_gromacs_pull\n+00025480: 696e 6726 2334 353b 2667 743b 6d6f 6475 ing->modu\n+00025490: 6c65 5f73 7263 5f67 726f 6d61 6373 5f64 le_src_gromacs_d\n+000254a0: 6f6d 6465 633c 2f74 6974 6c65 3e0a 3c70 omdec..<\n+00025530: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+00025540: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+00025550: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+00025560: 3138 3939 2e39 362c 2d34 3739 2e37 3920 1899.96,-479.79 \n+00025570: 3139 3039 2e34 2c2d 3437 342e 3939 2031 1909.4,-474.99 1\n+00025580: 3839 392e 3032 2c2d 3437 322e 3836 2031 899.02,-472.86 1\n+00025590: 3839 392e 3936 2c2d 3437 392e 3739 222f 899.96,-479.79\"/\n+000255a0: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >....mod\n+000257a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000257b0: 746f 706f 6c6f 6779 3c2f 7469 746c 653e topology\n+000257c0: 0a3c 656c 6c69 7073 6520 6669 6c6c 3d22 ..topology....modu\n+00025aa0: 6c65 5f73 7263 5f67 726f 6d61 6373 5f74 le_src_gromacs_t\n+00025ab0: 6f70 6f6c 6f67 7926 2334 353b 2667 743b opology->\n+00025ac0: 6d6f 6475 6c65 5f73 7263 5f74 6573 7475 module_src_testu\n+00025ad0: 7469 6c73 3c2f 7469 746c 653e 0a3c 7061 tils.....<\n+00025c70: 6720 6964 3d22 6564 6765 3236 3422 2063 g id=\"edge264\" c\n+00025c80: 6c61 7373 3d22 6564 6765 223e 0a3c 7469 lass=\"edge\">.module_src_g\n+00025ca0: 726f 6d61 6373 5f61 7070 6c69 6564 5f66 romacs_applied_f\n+00025cb0: 6f72 6365 735f 6177 6826 2334 353b 2667 orces_awh-&g\n+00025cc0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+00025cd0: 6d61 6373 5f6d 6472 756e 7574 696c 6974 macs_mdrunutilit\n+00025ce0: 793c 2f74 6974 6c65 3e0a 3c70 6174 6820 y...\n+00025e40: 0a3c 212d 2d20 6d6f 6475 6c65 5f73 7263 ...module_src_gr\n+000260d0: 6f6d 6163 735f 6170 706c 6965 645f 666f omacs_applied_fo\n+000260e0: 7263 6573 5f61 7768 2623 3435 3b26 6774 rces_awh->\n+000260f0: 3b6d 6f64 756c 655f 7372 635f 6772 6f6d ;module_src_grom\n+00026100: 6163 735f 6d64 7370 616e 3c2f 7469 746c acs_mdspan..<\n+00026240: 706f 6c79 676f 6e20 6669 6c6c 3d22 2332 polygon fill=\"#2\n+00026250: 3832 6663 6322 2073 7472 6f6b 653d 2223 82fcc\" stroke=\"#\n+00026260: 3238 3266 6363 2220 706f 696e 7473 3d22 282fcc\" points=\"\n+00026270: 3639 362e 3637 2c2d 3438 2e30 3720 3638 696.67,-48.07 68\n+00026280: 372e 3731 2c2d 3432 2e34 3220 3639 312e 7.71,-42.42 691.\n+00026290: 3139 2c2d 3532 2e34 3320 3639 362e 3637 19,-52.43 696.67\n+000262a0: 2c2d 3438 2e30 3722 2f3e 0a3c 2f67 3e0a ,-48.07\"/>..\n+000262b0: 3c21 2d2d 206d 6f64 756c 655f 7372 635f \n+00026300: 0a3c 6720 6964 3d22 6564 6765 3236 3322 ..<\n+00026320: 7469 746c 653e 6d6f 6475 6c65 5f73 7263 title>module_src\n+00026330: 5f67 726f 6d61 6373 5f61 7070 6c69 6564 _gromacs_applied\n+00026340: 5f66 6f72 6365 735f 6177 6826 2334 353b _forces_awh-\n+00026350: 2667 743b 6d6f 6475 6c65 5f73 7263 5f67 >module_src_g\n+00026360: 726f 6d61 6373 5f67 6d78 6c69 623c 2f74 romacs_gmxlib......module\n+000264d0: 5f73 7263 5f67 726f 6d61 6373 5f61 7070 _src_gromacs_app\n+000264e0: 6c69 6564 5f66 6f72 6365 735f 6177 6826 lied_forces_awh&\n+000264f0: 2334 353b 2667 743b 6d6f 6475 6c65 5f73 #45;>module_s\n+00026500: 7263 5f67 726f 6d61 6373 5f6d 6474 7970 rc_gromacs_mdtyp\n+00026510: 6573 3c2f 7469 746c 653e 0a3c 7061 7468 es..<\n+000265b0: 706f 6c79 676f 6e20 6669 6c6c 3d22 2362 polygon fill=\"#b\n+000265c0: 6662 6662 6622 2073 7472 6f6b 653d 2223 fbfbf\" stroke=\"#\n+000265d0: 6266 6266 6266 2220 706f 696e 7473 3d22 bfbfbf\" points=\"\n+000265e0: 3138 3735 2e36 342c 2d39 3130 2e32 3220 1875.64,-910.22 \n+000265f0: 3138 3835 2e37 362c 2d39 3037 2e31 3120 1885.76,-907.11 \n+00026600: 3138 3735 2e39 2c2d 3930 332e 3233 2031 1875.9,-903.23 1\n+00026610: 3837 352e 3634 2c2d 3931 302e 3232 222f 875.64,-910.22\"/\n+00026620: 3e0a 3c2f 673e 0a3c 212d 2d20 6d6f 6475 >....mod\n+000266a0: 756c 655f 7372 635f 6772 6f6d 6163 735f ule_src_gromacs_\n+000266b0: 6170 706c 6965 645f 666f 7263 6573 5f61 applied_forces_a\n+000266c0: 7768 2623 3435 3b26 6774 3b6d 6f64 756c wh->modul\n+000266d0: 655f 7372 635f 6772 6f6d 6163 735f 6669 e_src_gromacs_fi\n+000266e0: 6c65 696f 3c2f 7469 746c 653e 0a3c 7061 leio....<\n+00026880: 212d 2d20 6d6f 6475 6c65 5f73 7263 5f67 !-- module_src_g\n+00026890: 726f 6d61 6373 5f61 7070 6c69 6564 5f66 romacs_applied_f\n+000268a0: 6f72 6365 735f 6177 6826 2334 353b 2667 orces_awh-&g\n+000268b0: 743b 6d6f 6475 6c65 5f73 7263 5f67 726f t;module_src_gro\n+000268c0: 6d61 6373 5f74 7261 6a65 6374 6f72 7920 macs_trajectory \n+000268d0: 2d2d 3e0a 3c67 2069 643d 2265 6467 6532 -->..module_\n+00026900: 7372 635f 6772 6f6d 6163 735f 6170 706c src_gromacs_appl\n+00026910: 6965 645f 666f 7263 6573 5f61 7768 2623 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The graph below annotates the colors and line styles used in the module dependency graph above. More detailed textual annotation is below the graph.

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