Name | Last modified | Size | Description | |
---|---|---|---|---|
Parent Directory | - | |||
1SUO_tmi.coords | 2007-05-11 00:25 | 1.9M | ||
1SUO_tmi.coords.rand | 2007-05-11 00:50 | 3.8M | ||
1SUO_tmi.pdb | 2007-05-10 13:56 | 586K | ||
1SUO_tmi.topo | 2007-05-11 00:50 | 9.6M | ||
1SUO_tmi_vac.coords | 2007-05-10 13:57 | 271K | ||
1SUO_tmi_vac.min.out | 2007-05-10 14:30 | 89K | ||
1SUO_tmi_vac.min.rst | 2007-05-10 14:30 | 271K | ||
1SUO_tmi_vac.topo | 2007-05-10 13:57 | 2.9M | ||
CYP.off | 2007-05-10 23:49 | 2.2K | ||
SUO_ta.o903504 | 2009-04-19 20:04 | 1.7K | ||
SUO_ta2.o903505 | 2009-04-19 20:02 | 1.2K | ||
aa.coords | 2007-05-10 13:54 | 1.8M | ||
aa.topo | 2007-05-10 13:54 | 9.5M | ||
angle/ | 2018-07-03 16:38 | - | ||
angle2/ | 2018-07-03 16:38 | - | ||
avgpdb/ | 2007-09-22 04:31 | - | ||
buildit | 2007-05-11 00:08 | 600 | ||
cm5-ac.mol2 | 2007-05-10 13:54 | 7.5K | ||
cm5.mol2 | 2007-05-10 13:54 | 8.2K | ||
ener.1 | 2007-05-13 23:08 | 302K | ||
ener.2 | 2007-05-14 16:46 | 316K | ||
ener.3 | 2007-05-15 03:39 | 298K | ||
ener.4 | 2007-05-18 09:18 | 1.1M | ||
ener.5 | 2007-05-23 17:50 | 1.4M | ||
ener.6 | 2007-05-26 22:10 | 1.4M | ||
ener.7 | 2007-05-29 20:36 | 1.4M | ||
ener.8 | 2007-06-04 08:42 | 1.3M | ||
ener.9 | 2007-06-07 07:14 | 1.4M | ||
ener.10 | 2007-06-11 04:56 | 1.3M | ||
ener.11 | 2007-06-14 21:45 | 1.3M | ||
ener.12 | 2007-06-18 02:10 | 1.4M | ||
ener.13 | 2007-06-21 09:39 | 1.4M | ||
ener.14 | 2007-06-22 17:47 | 1.5M | ||
ener.15 | 2007-06-24 02:04 | 1.4M | ||
ener.16 | 2007-06-26 16:01 | 1.4M | ||
ener.17 | 2007-07-01 13:17 | 1.4M | ||
ener.18 | 2007-07-05 07:42 | 1.5M | ||
ener.19 | 2007-07-10 12:06 | 1.5M | ||
ener.20 | 2007-07-13 07:59 | 1.5M | ||
ener.21 | 2007-07-15 01:52 | 1.4M | ||
ener.22 | 2007-07-16 20:13 | 1.4M | ||
ener.23 | 2007-07-24 20:41 | 1.4M | ||
ener.24 | 2007-07-26 19:50 | 1.4M | ||
ener.25 | 2007-08-01 18:38 | 1.4M | ||
ener.26 | 2007-08-04 19:49 | 1.3M | ||
ener.27 | 2007-08-07 05:08 | 1.4M | ||
ener.28 | 2007-08-09 11:13 | 1.4M | ||
ener.29 | 2007-08-13 10:43 | 1.4M | ||
ener.30 | 2007-08-19 06:11 | 1.4M | ||
ener.31 | 2007-08-26 20:58 | 1.4M | ||
ener.32 | 2007-09-01 19:13 | 1.4M | ||
ener.33 | 2007-09-04 18:36 | 1.3M | ||
ener.34 | 2007-09-07 07:55 | 1.3M | ||
ener.35 | 2007-09-09 22:14 | 1.4M | ||
ener.36 | 2007-09-13 20:08 | 1.4M | ||
ener.37 | 2007-09-15 16:02 | 1.5M | ||
ener.38 | 2007-09-18 15:40 | 1.5M | ||
ener.39 | 2007-09-19 21:52 | 1.4M | ||
ener.41 | 2007-09-29 02:31 | 1.4M | ||
ener.42 | 2007-10-01 17:34 | 1.3M | ||
eq05.ene | 2007-05-13 05:40 | 186K | ||
eq05.out | 2007-05-13 05:40 | 227K | ||
eq05.rst | 2007-05-13 05:40 | 3.8M | ||
eq05.trj | 2007-05-13 05:40 | 318M | ||
eq05a.ene | 2007-05-13 13:22 | 182K | ||
eq05a.out | 2007-05-13 13:22 | 226K | ||
eq05a.rst | 2007-05-13 13:22 | 3.8M | ||
eq05a.trj | 2007-05-13 13:22 | 310M | ||
eq1.ene | 2007-05-13 01:52 | 37K | ||
eq1.out | 2007-05-13 01:52 | 57K | ||
eq1.rst | 2007-05-13 01:52 | 3.8M | ||
eq1.trj | 2007-05-13 01:52 | 63M | ||
eq2.ene | 2007-05-13 01:05 | 37K | ||
eq2.out | 2007-05-13 01:05 | 57K | ||
eq2.rst | 2007-05-13 01:05 | 3.8M | ||
eq2.trj | 2007-05-13 01:05 | 63M | ||
eq3.ene | 2007-05-13 00:19 | 37K | ||
eq3.out | 2007-05-13 00:19 | 57K | ||
eq3.rst | 2007-05-13 00:19 | 3.8M | ||
eq3.trj | 2007-05-13 00:19 | 63M | ||
eq4.ene | 2007-05-12 23:33 | 37K | ||
eq4.out | 2007-05-12 23:33 | 57K | ||
eq4.rst | 2007-05-12 23:33 | 3.8M | ||
eq4.trj | 2007-05-12 23:33 | 63M | ||
eq5.ene | 2007-05-12 16:41 | 37K | ||
eq5.out | 2007-05-12 16:41 | 57K | ||
eq5.rst | 2007-05-12 16:41 | 3.8M | ||
eq5.trj | 2007-05-12 16:41 | 63M | ||
frcmod_smith_dang | 2007-05-10 13:54 | 466 | ||
gaff.dat | 2007-05-10 13:54 | 316K | ||
heat.ene | 2007-05-12 15:55 | 74K | ||
heat.out | 2007-05-12 15:55 | 84K | ||
heat.rst | 2007-05-12 15:55 | 3.8M | ||
heat.trj | 2007-05-12 15:55 | 126M | ||
heme.off | 2007-05-10 13:54 | 10K | ||
hemes3.frcmod | 2007-05-10 13:54 | 9.4K | ||
inputs/ | 2007-10-08 14:48 | - | ||
leap.log | 2007-05-11 00:28 | 80K | ||
mdinfo | 2007-10-01 17:34 | 794 | ||
mdout.1 | 2007-05-13 23:08 | 439K | ||
mdout.2 | 2007-05-14 16:46 | 459K | ||
mdout.3 | 2007-05-15 03:39 | 433K | ||
mdout.4 | 2007-05-18 09:18 | 1.6M | ||
mdout.5 | 2007-05-23 17:50 | 2.0M | ||
mdout.6 | 2007-05-26 22:10 | 2.0M | ||
mdout.7 | 2007-05-29 20:36 | 2.1M | ||
mdout.8 | 2007-06-04 08:42 | 1.9M | ||
mdout.9 | 2007-06-07 07:14 | 2.0M | ||
mdout.10 | 2007-06-11 04:56 | 1.8M | ||
mdout.11 | 2007-06-14 21:45 | 1.9M | ||
mdout.12 | 2007-06-18 02:10 | 2.0M | ||
mdout.13 | 2007-06-21 09:39 | 2.0M | ||
mdout.14 | 2007-06-22 17:47 | 2.1M | ||
mdout.15 | 2007-06-24 02:04 | 2.0M | ||
mdout.16 | 2007-06-26 16:01 | 2.0M | ||
mdout.17 | 2007-07-01 13:17 | 2.1M | ||
mdout.18 | 2007-07-05 07:42 | 2.1M | ||
mdout.19 | 2007-07-10 12:06 | 2.1M | ||
mdout.20 | 2007-07-13 07:59 | 2.1M | ||
mdout.21 | 2007-07-15 01:52 | 2.0M | ||
mdout.22 | 2007-07-16 20:13 | 2.0M | ||
mdout.23 | 2007-07-24 20:41 | 2.1M | ||
mdout.24 | 2007-07-26 19:50 | 2.0M | ||
mdout.25 | 2007-08-01 18:38 | 2.0M | ||
mdout.26 | 2007-08-04 19:49 | 1.9M | ||
mdout.27 | 2007-08-07 05:08 | 2.0M | ||
mdout.28 | 2007-08-09 11:13 | 2.0M | ||
mdout.29 | 2007-08-13 10:43 | 2.0M | ||
mdout.30 | 2007-08-19 06:11 | 2.0M | ||
mdout.31 | 2007-08-26 20:58 | 2.0M | ||
mdout.32 | 2007-09-01 19:13 | 2.0M | ||
mdout.33 | 2007-09-04 18:36 | 1.8M | ||
mdout.34 | 2007-09-07 07:55 | 1.9M | ||
mdout.35 | 2007-09-09 22:14 | 2.0M | ||
mdout.36 | 2007-09-13 20:08 | 2.0M | ||
mdout.37 | 2007-09-15 16:02 | 2.1M | ||
mdout.38 | 2007-09-18 15:40 | 2.1M | ||
mdout.39 | 2007-09-19 21:52 | 2.0M | ||
mdout.41 | 2007-09-29 02:31 | 2.0M | ||
mdout.42 | 2007-10-01 17:34 | 1.8M | ||
min.in | 2007-05-10 14:21 | 244 | ||
min.pdb | 2007-05-10 23:50 | 408K | ||
mini.out | 2007-05-11 00:55 | 23K | ||
mini.rst | 2007-05-11 00:55 | 1.9M | ||
mini1.out | 2007-05-13 01:07 | 23K | ||
mini1.pdb | 2007-05-10 13:54 | 2.9M | ||
mini1.rst | 2007-05-13 01:07 | 1.9M | ||
mini2.out | 2007-05-13 00:20 | 23K | ||
mini2.rst | 2007-05-13 00:20 | 1.9M | ||
mini3.out | 2007-05-12 23:34 | 23K | ||
mini3.rst | 2007-05-12 23:34 | 1.9M | ||
mini4.out | 2007-05-12 22:48 | 67K | ||
mini4.rst | 2007-05-12 22:48 | 1.9M | ||
mini5.out | 2007-05-12 15:57 | 23K | ||
mini5.rst | 2007-05-12 15:57 | 1.9M | ||
n_1SUO_tmi.e2811 | 2007-05-11 01:54 | 3.2K | ||
n_1SUO_tmi.e2943 | 2007-05-12 16:44 | 1.1K | ||
n_1SUO_tmi.e3032 | 2007-05-12 22:31 | 1.1K | ||
n_1SUO_tmi.e3037 | 2007-05-12 22:37 | 1.1K | ||
n_1SUO_tmi.e3048 | 2007-05-13 05:41 | 2.9K | ||
n_1SUO_tmi.e3141 | 2007-05-13 09:50 | 0 | ||
n_1SUO_tmi.e3209 | 2007-05-13 23:08 | 2.9K | ||
n_1SUO_tmi.e3290 | 2007-05-14 16:46 | 3.3K | ||
n_1SUO_tmi.e3393 | 2007-05-15 03:39 | 2.7K | ||
n_1SUO_tmi.o2811 | 2007-05-11 01:54 | 2.7K | ||
n_1SUO_tmi.o2943 | 2007-05-12 16:44 | 1.6K | ||
n_1SUO_tmi.o3032 | 2007-05-12 22:31 | 1.6K | ||
n_1SUO_tmi.o3037 | 2007-05-12 22:37 | 1.6K | ||
n_1SUO_tmi.o3048 | 2007-05-13 05:41 | 2.6K | ||
n_1SUO_tmi.o3141 | 2007-05-13 13:22 | 1.6K | ||
n_1SUO_tmi.o3209 | 2007-05-13 23:08 | 2.6K | ||
n_1SUO_tmi.o3290 | 2007-05-14 16:46 | 2.6K | ||
n_1SUO_tmi.o3393 | 2007-05-15 03:39 | 2.6K | ||
out.e478997 | 2007-09-29 02:31 | 214 | ||
out.e484018 | 2007-10-01 17:34 | 5.8K | ||
out.o478997 | 2007-09-29 02:32 | 4.5K | ||
out.o484018 | 2007-10-01 17:35 | 4.5K | ||
prmtop | 2007-05-11 00:50 | 9.6M | ||
profile_mpi | 2007-05-13 13:22 | 147K | ||
protonate.pdb | 2007-05-10 13:54 | 417K | ||
randomize_ions.in | 2007-05-11 00:30 | 126 | ||
restrain_tmi | 2007-05-10 13:58 | 91 | ||
restrt.0 | 2007-05-13 17:07 | 3.8M | ||
restrt.1 | 2007-05-13 23:08 | 3.8M | ||
restrt.2 | 2007-05-14 16:46 | 3.8M | ||
restrt.3 | 2007-05-15 03:39 | 3.8M | ||
restrt.4 | 2007-05-18 09:18 | 3.8M | ||
restrt.5 | 2007-05-23 17:50 | 3.8M | ||
restrt.6 | 2007-05-26 22:10 | 3.8M | ||
restrt.7 | 2007-05-29 20:36 | 3.8M | ||
restrt.8 | 2007-06-04 08:42 | 3.8M | ||
restrt.9 | 2007-06-07 07:14 | 3.8M | ||
restrt.10 | 2007-06-11 04:56 | 3.8M | ||
restrt.11 | 2007-06-14 21:45 | 3.8M | ||
restrt.12 | 2007-06-18 02:10 | 3.8M | ||
restrt.13 | 2007-06-21 09:39 | 3.8M | ||
restrt.14 | 2007-06-22 17:47 | 3.8M | ||
restrt.15 | 2007-06-24 02:04 | 3.8M | ||
restrt.16 | 2007-06-26 16:01 | 3.8M | ||
restrt.17 | 2007-07-01 13:17 | 3.8M | ||
restrt.18 | 2007-07-05 07:42 | 3.8M | ||
restrt.19 | 2007-07-10 12:06 | 3.8M | ||
restrt.20 | 2007-07-13 07:59 | 3.8M | ||
restrt.21 | 2007-07-15 01:52 | 3.8M | ||
restrt.22 | 2007-07-16 20:13 | 3.8M | ||
restrt.23 | 2007-07-24 20:41 | 3.8M | ||
restrt.24 | 2007-07-26 19:50 | 3.8M | ||
restrt.25 | 2007-08-01 18:38 | 3.8M | ||
restrt.26 | 2007-08-04 19:49 | 3.8M | ||
restrt.27 | 2007-08-07 05:08 | 3.8M | ||
restrt.28 | 2007-08-09 11:13 | 3.8M | ||
restrt.29 | 2007-08-13 10:43 | 3.8M | ||
restrt.30 | 2007-08-19 06:11 | 3.8M | ||
restrt.31 | 2007-08-26 20:58 | 3.8M | ||
restrt.32 | 2007-09-01 19:13 | 3.8M | ||
restrt.33 | 2007-09-04 18:36 | 3.8M | ||
restrt.34 | 2007-09-07 07:55 | 3.8M | ||
restrt.35 | 2007-09-09 22:14 | 3.8M | ||
restrt.36 | 2007-09-13 20:08 | 3.8M | ||
restrt.37 | 2007-09-15 16:02 | 3.8M | ||
restrt.38 | 2007-09-18 15:40 | 3.8M | ||
restrt.39 | 2007-09-19 21:52 | 3.8M | ||
restrt.40 | 2007-09-24 02:33 | 3.8M | ||
restrt.41 | 2007-09-29 02:31 | 3.8M | ||
restrt.42 | 2007-10-01 17:34 | 3.8M | ||
rms | 2007-09-24 03:28 | 1.4M | ||
rms-all | 2007-09-24 03:28 | 1.4M | ||
runit | 2007-09-30 10:23 | 353 | ||
runit.0 | 2007-05-14 21:38 | 521 | ||
runit.3 | 2007-05-15 17:41 | 351 | ||
runit.4 | 2007-05-15 17:40 | 351 | ||
runit.equil | 2007-05-13 09:49 | 2.2K | ||
strip.in | 2007-09-23 14:29 | 8.1K | ||
strip.out | 2007-09-24 03:28 | 121K | ||
tmi-ac.mol2 | 2007-05-10 13:54 | 4.3K | ||
tmi.mol2 | 2007-05-10 13:54 | 4.7K | ||
tmi.mol2.bal | 2007-05-10 13:54 | 4.7K | ||
tmi.pdb | 2007-05-10 13:54 | 1.9K | ||