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buildit-full.in | 2016-05-03 09:56 | 262 | ||
buildit-full.log | 2016-05-03 09:56 | 5.0K | ||
buildit-vac.in | 2016-05-03 09:56 | 167 | ||
buildit-vac.log | 2016-05-03 09:56 | 2.6K | ||
equil.log | 2016-05-03 10:40 | 72 | ||
full.pdb | 2016-05-03 09:56 | 262K | ||
full.topo | 2016-05-03 09:56 | 551K | ||
full.topo.hmr | 2016-05-03 09:57 | 545K | ||
init.pdb | 2016-05-03 09:56 | 4.3K | ||
leap.log | 2016-05-03 09:56 | 194K | ||
noWAt.topo.hmr | 2016-06-07 18:04 | 45K | ||
non-randomized.crds | 2016-05-03 09:56 | 118K | ||
parmed-HMR.log | 2016-05-03 09:57 | 784 | ||
pt-randomize.log | 2016-05-03 09:56 | 2.4K | ||
rand.crds | 2016-05-03 09:56 | 118K | ||
set-waters.log | 2016-05-03 09:56 | 560 | ||
step1.in | 2016-05-03 10:07 | 283 | ||
step1.mdinfo | 2016-05-03 10:07 | 384 | ||
step1.out | 2016-05-03 10:07 | 20K | ||
step1.rst | 2016-05-03 10:07 | 78K | ||
step1.traj | 2016-05-03 10:07 | 784 | ||
step2.in | 2016-05-03 10:07 | 426 | ||
step2.mdinfo | 2016-05-03 10:07 | 401 | ||
step2.out | 2016-05-03 10:07 | 167K | ||
step2.rst | 2016-05-03 10:07 | 156K | ||
step2.traj | 2016-05-03 10:07 | 1.1M | ||
step3.in | 2016-05-03 10:07 | 292 | ||
step3.mdinfo | 2016-05-03 10:07 | 384 | ||
step3.out | 2016-05-03 10:07 | 20K | ||
step3.rst | 2016-05-03 10:07 | 78K | ||
step3.traj | 2016-05-03 10:07 | 784 | ||
step4.in | 2016-05-03 10:07 | 292 | ||
step4.mdinfo | 2016-05-03 10:07 | 384 | ||
step4.out | 2016-05-03 10:07 | 20K | ||
step4.rst | 2016-05-03 10:07 | 78K | ||
step4.traj | 2016-05-03 10:07 | 784 | ||
step5.in | 2016-05-03 10:07 | 235 | ||
step5.mdinfo | 2016-05-03 10:07 | 384 | ||
step5.out | 2016-05-03 10:07 | 19K | ||
step5.rst | 2016-05-03 10:07 | 78K | ||
step5.traj | 2016-05-03 10:07 | 784 | ||
step6.in | 2016-05-03 10:07 | 429 | ||
step6.mdinfo | 2016-05-03 10:07 | 561 | ||
step6.out | 2016-05-03 10:07 | 81K | ||
step6.rst | 2016-05-03 10:07 | 156K | ||
step6.traj | 2016-05-03 10:07 | 388K | ||
step7.in | 2016-05-03 10:07 | 434 | ||
step7.mdinfo | 2016-05-03 10:23 | 1.2K | ||
step7.out | 2016-05-03 10:24 | 13M | ||
step7.rst | 2016-05-03 10:24 | 156K | ||
step7.traj | 2016-05-03 10:24 | 76M | ||
step8.in | 2016-05-03 10:07 | 452 | ||
step8.mdinfo | 2016-05-03 10:39 | 1.2K | ||
step8.out | 2016-05-03 10:40 | 13M | ||
step8.rst | 2016-05-03 10:40 | 156K | ||
step8.traj | 2016-05-03 10:40 | 76M | ||
step9.in | 2016-05-03 10:07 | 380 | ||
step9.mdinfo | 2016-05-03 10:48 | 1.2K | ||
step9.out | 2016-05-03 10:48 | 6.2M | ||
step9.rst | 2016-05-03 10:48 | 156K | ||
step9.traj | 2016-05-03 10:48 | 38M | ||