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buildit-full.in | 2015-11-30 15:32 | 265 | ||
buildit-full.log | 2015-11-30 15:32 | 4.6K | ||
equil.log | 2015-11-30 15:32 | 72 | ||
full.pdb | 2015-11-30 15:32 | 346K | ||
full.topo | 2015-11-30 15:32 | 722K | ||
full.topo.hmr | 2015-11-30 15:32 | 717K | ||
init.pdb | 2015-11-30 15:32 | 3.9K | ||
leap.log | 2015-11-30 15:32 | 161K | ||
logfile | 2015-11-30 15:32 | 46K | ||
logtest.o1258739 | 2015-11-30 15:32 | 153 | ||
md-cpu-git.runit | 2015-11-30 15:32 | 402 | ||
noWAt.topo.hmr | 2015-11-30 15:32 | 40K | ||
non-randomized.crds | 2015-11-30 15:32 | 156K | ||
parmed-HMR.log | 2015-11-30 15:32 | 944 | ||
pt-randomize.in | 2015-11-30 15:32 | 137 | ||
pt-randomize.log | 2015-11-30 15:32 | 2.2K | ||
rand.crds | 2015-11-30 15:32 | 156K | ||
set-waters.log | 2015-11-30 15:32 | 560 | ||
step1.in | 2015-11-30 15:32 | 283 | ||
step1.mdinfo | 2015-11-30 15:32 | 384 | ||
step1.out | 2015-11-30 15:32 | 19K | ||
step1.rst | 2015-11-30 15:32 | 156K | ||
step2.in | 2015-11-30 15:32 | 426 | ||
step2.mdinfo | 2015-11-30 15:32 | 437 | ||
step2.out | 2015-11-30 15:32 | 177K | ||
step2.rst | 2015-11-30 15:32 | 312K | ||
step3.in | 2015-11-30 15:32 | 292 | ||
step3.mdinfo | 2015-11-30 15:32 | 384 | ||
step3.out | 2015-11-30 15:32 | 19K | ||
step3.rst | 2015-11-30 15:32 | 156K | ||
step4.in | 2015-11-30 15:32 | 292 | ||
step4.mdinfo | 2015-11-30 15:32 | 384 | ||
step4.out | 2015-11-30 15:32 | 19K | ||
step4.rst | 2015-11-30 15:32 | 156K | ||
step5.in | 2015-11-30 15:32 | 235 | ||
step5.mdinfo | 2015-11-30 15:32 | 384 | ||
step5.out | 2015-11-30 15:32 | 18K | ||
step5.rst | 2015-11-30 15:32 | 156K | ||
step6.in | 2015-11-30 15:32 | 429 | ||
step6.mdinfo | 2015-11-30 15:32 | 597 | ||
step6.out | 2015-11-30 15:32 | 84K | ||
step6.rst | 2015-11-30 15:32 | 312K | ||
step7.in | 2015-11-30 15:32 | 434 | ||
step7.mdinfo | 2015-11-30 15:32 | 1.2K | ||
step7.out | 2015-11-30 15:32 | 14M | ||
step7.rst | 2015-11-30 15:32 | 312K | ||
step8.in | 2015-11-30 15:32 | 452 | ||
step8.mdinfo | 2015-11-30 15:32 | 1.2K | ||
step8.out | 2015-11-30 15:32 | 14M | ||
step8.rst | 2015-11-30 15:32 | 312K | ||
step9.in | 2015-11-30 15:32 | 380 | ||
step9.mdinfo | 2015-11-30 15:32 | 1.2K | ||
step9.out | 2015-11-30 15:32 | 6.5M | ||
step9.rst | 2015-11-30 15:32 | 312K | ||