Name | Last modified | Size | Description | |
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Parent Directory | - | |||
ALL_Protomers | 2020-01-18 13:28 | 2.7M | ||
ALL_Protomers_left | 2020-01-18 13:28 | 504K | ||
ALL_Protomers_worked | 2020-01-18 13:28 | 222K | ||
All-check26.smi | 2019-12-02 17:58 | 2.0M | ||
BUILDING-STATS | 2020-01-18 13:28 | 39 | ||
FAILED-ERROR | 2020-01-14 12:11 | 56 | ||
FINISHED | 2020-01-18 13:28 | 216 | ||
FINISHED_LEFT | 2020-01-18 13:28 | 56 | ||
FINISHED_WORKED | 2020-01-18 13:28 | 56 | ||
Filter_for_resubmiss..> | 2020-01-16 19:46 | 436 | ||
Filter_for_resubmiss..> | 2020-01-16 19:46 | 503 | ||
JUST-Looking-for-fai..> | 2020-01-13 10:32 | 659 | ||
NOT-FINISHED | 2020-01-18 13:28 | 56 | ||
Name | 2020-01-18 13:28 | 12 | ||
PROTOMERS-mon-anion | 2020-01-18 13:28 | 2.5M | ||
PROTOMERS-mult-anion | 2020-01-18 13:28 | 91K | ||
PROTOMERS-neutral | 2020-01-18 13:28 | 48K | ||
PROTOMERS-uniq | 2020-01-18 13:28 | 437K | ||
PROTOMERS_LEFT-mon-a..> | 2020-01-18 13:28 | 472K | ||
PROTOMERS_LEFT-mult-..> | 2020-01-18 13:28 | 23K | ||
PROTOMERS_LEFT-neutral | 2020-01-18 13:28 | 8.6K | ||
PROTOMERS_LEFT-uniq | 2020-01-18 13:28 | 80K | ||
PROTOMERS_WORKED-mon..> | 2020-01-18 13:28 | 214K | ||
PROTOMERS_WORKED-mul..> | 2020-01-18 13:28 | 7.4K | ||
PROTOMERS_WORKED-neu..> | 2020-01-18 13:28 | 844 | ||
PROTOMERS_WORKED-uniq | 2020-01-18 13:28 | 36K | ||
build-working.sh | 2020-01-14 12:13 | 580 | ||
build_database_ligan..> | 2020-01-14 12:13 | 31K | ||
check-until-works.sh | 2020-01-14 12:19 | 667 | ||
check_finished.sh | 2020-01-18 13:28 | 220 | ||
check_finished_left.sh | 2020-01-18 13:28 | 308 | ||
check_finished_worke..> | 2020-01-18 13:28 | 294 | ||
check_protonation.sh | 2020-01-18 13:28 | 379 | ||
check_protonation_le..> | 2020-01-18 13:28 | 462 | ||
check_protonation_wo..> | 2020-01-18 13:28 | 469 | ||
list-left | 2020-01-14 12:21 | 91 | ||
list-qsub-worked | 2020-01-14 12:16 | 168 | ||
list-qsub_left_resubmit | 2020-01-14 12:36 | 217 | ||
list_splits | 2019-12-04 09:28 | 272 | ||
logs/ | 2020-01-17 21:49 | - | ||
make-qsub-left-resub..> | 2020-01-14 12:36 | 253 | ||
num-mol | 2020-01-18 13:28 | 6 | ||
num-mon-an | 2020-01-18 13:28 | 6 | ||
num-mult-an | 2020-01-18 13:28 | 5 | ||
num-neut | 2020-01-18 13:28 | 4 | ||
num-prot | 2020-01-18 13:28 | 6 | ||
ori-xaaaaah_worked | 2020-01-16 19:46 | 38K | ||
ori-xaaaaaq_left-res..> | 2020-01-16 19:46 | 27K | ||
ori-xaaaaar_left-res..> | 2020-01-16 19:46 | 33K | ||
ori-xaaaaat_left-res..> | 2020-01-16 19:46 | 54K | ||
problem-patterns | 2020-01-16 19:46 | 42 | ||
qsub_xaaaaaa.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaab.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaac.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaad.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaae.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaae_left-re..> | 2020-01-14 12:36 | 2.9K | ||
qsub_xaaaaae_worked.csh | 2020-01-14 12:15 | 2.8K | ||
qsub_xaaaaaf.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaag.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaah.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaah_left-re..> | 2020-01-14 12:36 | 2.9K | ||
qsub_xaaaaah_worked.csh | 2020-01-14 12:15 | 2.8K | ||
qsub_xaaaaai.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaaj.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaak.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaal.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaam.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaam_left-re..> | 2020-01-14 12:36 | 2.9K | ||
qsub_xaaaaam_worked.csh | 2020-01-14 12:16 | 2.8K | ||
qsub_xaaaaan.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaao.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaap.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaaq.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaaq_left-re..> | 2020-01-14 12:36 | 2.9K | ||
qsub_xaaaaaq_worked.csh | 2020-01-14 12:16 | 2.8K | ||
qsub_xaaaaar.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaar_left-re..> | 2020-01-14 12:36 | 2.9K | ||
qsub_xaaaaar_worked.csh | 2020-01-14 12:16 | 2.8K | ||
qsub_xaaaaas.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaat.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaat_left-re..> | 2020-01-14 12:36 | 2.9K | ||
qsub_xaaaaat_worked.csh | 2020-01-14 12:16 | 2.8K | ||
qsub_xaaaaau.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaav.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaaw.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaax.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaax_left-re..> | 2020-01-14 12:36 | 2.9K | ||
qsub_xaaaaax_worked.csh | 2020-01-14 12:16 | 2.8K | ||
qsub_xaaaaay.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaaz.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaaba.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaabb.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaabc.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaabd.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaabe.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaabf.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaabg.csh | 2019-12-02 18:00 | 2.8K | ||
qsub_xaaaabh.csh | 2019-12-02 18:00 | 2.8K | ||
resubmit-left-resubm..> | 2020-01-14 12:36 | 74 | ||
resubmit-worked.sh | 2020-01-14 12:16 | 67 | ||
resubmit.sh | 2020-01-13 10:32 | 157 | ||
resubmit_left.sh | 2020-01-17 21:36 | 242 | ||
xaaaaaa_build/ | 2019-12-04 02:59 | - | ||
xaaaaab_build/ | 2019-12-04 02:47 | - | ||
xaaaaac_build/ | 2019-12-04 03:13 | - | ||
xaaaaad_build/ | 2019-12-04 04:59 | - | ||
xaaaaae_build/ | 2020-01-14 12:11 | - | ||
xaaaaae_left | 2020-01-14 12:15 | 58K | ||
xaaaaae_left-resubmi..> | 2020-01-14 18:29 | - | ||
xaaaaae_left-test/ | 2020-01-14 12:22 | - | ||
xaaaaae_worked_build/ | 2020-01-14 12:58 | - | ||
xaaaaaf_build/ | 2019-12-04 05:21 | - | ||
xaaaaag_build/ | 2019-12-04 04:41 | - | ||
xaaaaah_build/ | 2020-01-14 12:11 | - | ||
xaaaaah_left | 2020-01-14 12:15 | 25K | ||
xaaaaah_left-resubmi..> | 2020-01-14 14:19 | - | ||
xaaaaah_left-test/ | 2020-01-14 12:23 | - | ||
xaaaaah_worked_build/ | 2020-01-16 22:54 | - | ||
xaaaaai_build/ | 2019-12-04 06:18 | - | ||
xaaaaaj_build/ | 2019-12-04 04:10 | - | ||
xaaaaak_build/ | 2019-12-04 05:30 | - | ||
xaaaaal_build/ | 2019-12-04 03:06 | - | ||
xaaaaam_build/ | 2020-01-14 12:11 | - | ||
xaaaaam_left | 2020-01-14 12:16 | 41K | ||
xaaaaam_left-resubmi..> | 2020-01-14 18:17 | - | ||
xaaaaam_left-test/ | 2020-01-14 12:26 | - | ||
xaaaaam_worked_build/ | 2020-01-14 13:50 | - | ||
xaaaaan_build/ | 2019-12-04 03:28 | - | ||
xaaaaao_build/ | 2019-12-04 03:42 | - | ||
xaaaaap_build/ | 2019-12-04 03:23 | - | ||
xaaaaaq_build/ | 2020-01-14 12:11 | - | ||
xaaaaaq_left | 2020-01-14 12:16 | 27K | ||
xaaaaaq_left-resubmi..> | 2020-01-16 21:26 | - | ||
xaaaaaq_left-test/ | 2020-01-14 12:28 | - | ||
xaaaaaq_worked_build/ | 2020-01-14 15:19 | - | ||
xaaaaar_build/ | 2020-01-14 12:11 | - | ||
xaaaaar_left | 2020-01-14 12:16 | 33K | ||
xaaaaar_left-resubmi..> | 2020-01-18 01:13 | - | ||
xaaaaar_left-test/ | 2020-01-14 12:30 | - | ||
xaaaaar_worked_build/ | 2020-01-14 14:28 | - | ||
xaaaaas_build/ | 2019-12-04 04:16 | - | ||
xaaaaat_build/ | 2020-01-14 12:11 | - | ||
xaaaaat_left | 2020-01-14 12:16 | 54K | ||
xaaaaat_left-resubmi..> | 2020-01-16 22:12 | - | ||
xaaaaat_left-test/ | 2020-01-14 12:35 | - | ||
xaaaaat_worked_build/ | 2020-01-14 13:04 | - | ||
xaaaaau_build/ | 2019-12-04 03:32 | - | ||
xaaaaav_build/ | 2019-12-04 02:46 | - | ||
xaaaaaw_build/ | 2019-12-04 02:21 | - | ||
xaaaaax_build/ | 2020-01-14 12:11 | - | ||
xaaaaax_left | 2020-01-14 12:16 | 55K | ||
xaaaaax_left-resubmi..> | 2020-01-14 17:58 | - | ||
xaaaaax_left-test/ | 2020-01-14 12:33 | - | ||
xaaaaax_worked_build/ | 2020-01-14 13:06 | - | ||
xaaaaay_build/ | 2019-12-04 02:37 | - | ||
xaaaaaz_build/ | 2019-12-04 06:27 | - | ||
xaaaaba_build/ | 2019-12-04 02:51 | - | ||
xaaaabb_build/ | 2019-12-04 04:38 | - | ||
xaaaabc_build/ | 2019-12-04 03:51 | - | ||
xaaaabd_build/ | 2019-12-06 14:59 | - | ||
xaaaabe_build/ | 2019-12-04 04:08 | - | ||
xaaaabf_build/ | 2019-12-04 02:40 | - | ||
xaaaabg_build/ | 2019-12-04 03:21 | - | ||
xaaaabh_build/ | 2019-12-04 00:14 | - | ||