Name | Last modified | Size | Description | |
---|---|---|---|---|
Parent Directory | - | |||
ALL_Protomers | 2020-01-07 14:59 | 1.2M | ||
PROTOMERS-mon-anion | 2020-01-07 14:59 | 927K | ||
All-check5.smi | 2019-12-02 17:15 | 652K | ||
PROTOMERS-mult-anion | 2020-01-07 14:59 | 208K | ||
PROTOMERS-uniq | 2020-01-07 14:59 | 182K | ||
PROTOMERS-neutral | 2020-01-07 14:59 | 117K | ||
qsub_xaaaaak.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaaj.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaai.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaah.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaag.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaaf.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaae.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaad.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaac.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaab.csh | 2019-12-02 17:18 | 2.8K | ||
qsub_xaaaaaa.csh | 2019-12-02 17:18 | 2.8K | ||
check_protonation.sh | 2019-12-04 11:26 | 379 | ||
check_finished.sh | 2019-12-04 09:21 | 220 | ||
resubmit.sh | 2019-12-04 09:22 | 153 | ||
list_splits | 2019-12-04 09:21 | 88 | ||
FINISHED | 2020-01-07 14:59 | 88 | ||
BUILDING-STATS | 2020-01-07 14:59 | 38 | ||
Name | 2020-01-07 14:59 | 11 | ||
num-prot | 2020-01-07 14:59 | 6 | ||
num-mol | 2020-01-07 14:59 | 6 | ||
num-neut | 2020-01-07 14:59 | 5 | ||
num-mult-an | 2020-01-07 14:59 | 5 | ||
num-mon-an | 2020-01-07 14:59 | 5 | ||
xaaaaak_build/ | 2019-12-03 15:17 | - | ||
xaaaaaj_build/ | 2019-12-06 08:55 | - | ||
xaaaaai_build/ | 2019-12-06 08:35 | - | ||
xaaaaah_build/ | 2019-12-03 14:50 | - | ||
xaaaaag_build/ | 2019-12-03 14:48 | - | ||
xaaaaaf_build/ | 2019-12-06 08:23 | - | ||
xaaaaae_build/ | 2019-12-03 15:12 | - | ||
xaaaaad_build/ | 2019-12-03 15:58 | - | ||
xaaaaac_build/ | 2019-12-06 08:31 | - | ||
xaaaaab_build/ | 2019-12-03 16:24 | - | ||
xaaaaaa_build/ | 2019-12-06 10:14 | - | ||
logs/ | 2019-12-06 06:39 | - | ||