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buildit-full.in | 2016-02-11 12:47 | 256 | ||
buildit-full.log | 2016-02-11 12:47 | 4.0K | ||
buildit-vac.in | 2016-02-10 16:51 | 169 | ||
buildit-vac.log | 2016-02-10 16:52 | 2.5K | ||
equil.log | 2016-02-11 14:06 | 128 | ||
full.pdb | 2016-02-11 12:48 | 263K | ||
full.topo | 2016-02-11 12:47 | 550K | ||
full.topo.hmr | 2016-02-11 12:07 | 545K | ||
init.pdb | 2016-02-10 16:52 | 4.1K | ||
leap.log | 2016-02-11 12:47 | 367K | ||
logfile | 2016-02-11 14:26 | 51K | ||
logtest.o31846 | 2016-02-11 12:46 | 306 | ||
logtest.o31849 | 2016-02-11 14:26 | 74 | ||
md-te-git.runit | 2016-02-11 12:21 | 452 | ||
noWAt.topo.hmr | 2016-03-22 11:56 | 42K | ||
non-randomized.pdb | 2016-02-10 16:59 | 263K | ||
parmed-HMR.log | 2016-02-11 12:47 | 2.1K | ||
parmed.log | 2016-04-18 18:39 | 244 | ||
rand.crds | 2016-02-11 12:47 | 118K | ||
set-waters-fixedions..> | 2016-02-11 12:46 | 5.7K | ||
set-waters.log | 2016-02-11 12:47 | 603 | ||
step1.in | 2016-02-11 12:48 | 283 | ||
step1.mdinfo | 2016-02-11 12:48 | 384 | ||
step1.out | 2016-02-11 12:48 | 18K | ||
step1.rst | 2016-02-11 12:48 | 118K | ||
step2.in | 2016-02-11 12:48 | 426 | ||
step2.mdinfo | 2016-02-11 12:48 | 437 | ||
step2.out | 2016-02-11 12:48 | 176K | ||
step2.rst | 2016-02-11 12:48 | 237K | ||
step3.in | 2016-02-11 12:48 | 292 | ||
step3.mdinfo | 2016-02-11 12:48 | 384 | ||
step3.out | 2016-02-11 12:49 | 18K | ||
step3.rst | 2016-02-11 12:49 | 118K | ||
step4.in | 2016-02-11 12:48 | 292 | ||
step4.mdinfo | 2016-02-11 12:49 | 384 | ||
step4.out | 2016-02-11 12:49 | 18K | ||
step4.rst | 2016-02-11 12:49 | 118K | ||
step5.in | 2016-02-11 12:48 | 235 | ||
step5.mdinfo | 2016-02-11 12:49 | 384 | ||
step5.out | 2016-02-11 12:49 | 18K | ||
step5.rst | 2016-02-11 12:49 | 118K | ||
step6.in | 2016-02-11 12:48 | 429 | ||
step6.mdinfo | 2016-02-11 12:49 | 597 | ||
step6.out | 2016-02-11 12:49 | 83K | ||
step6.rst | 2016-02-11 12:49 | 237K | ||
step7.in | 2016-02-11 12:48 | 434 | ||
step7.mdinfo | 2016-02-11 13:28 | 1.2K | ||
step7.out | 2016-02-11 13:28 | 14M | ||
step7.rst | 2016-02-11 13:28 | 237K | ||
step8.in | 2016-02-11 12:48 | 452 | ||
step8.mdinfo | 2016-02-11 14:05 | 1.2K | ||
step8.out | 2016-02-11 14:06 | 14M | ||
step8.rst | 2016-02-11 14:06 | 237K | ||
step9.in | 2016-02-11 12:48 | 380 | ||
step9.mdinfo | 2016-02-11 14:26 | 1.2K | ||
step9.out | 2016-02-11 14:26 | 6.5M | ||
step9.rst | 2016-02-11 14:26 | 237K | ||