Workunit 31589681
| name | shp2_A18_A04_r0_3-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND5004 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:41:21 UTC |
| minimum quorum | 1 |
| initial replication | 1 |
| max # of error/total/success tasks | 7, 10, 6 |
| errors | Too many errors (may have bug) |
| Task click for details | Computer | Sent | Time reported or deadline explain | Status | Run time (sec) | CPU time (sec) | Credit | Application |
|---|---|---|---|---|---|---|---|---|
| 38643062 | 602586 | 7 May 2026, 10:41:30 UTC | 7 May 2026, 12:05:36 UTC | Error while computing | 4,759.11 | 2,669.63 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643300 | 549691 | 7 May 2026, 12:05:44 UTC | 7 May 2026, 23:15:47 UTC | Error while computing | 822.12 | 777.55 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643930 | 648535 | 7 May 2026, 23:16:02 UTC | 7 May 2026, 23:30:19 UTC | Error while computing | 751.07 | 746.78 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643948 | 650754 | 7 May 2026, 23:30:25 UTC | 8 May 2026, 11:53:31 UTC | Error while computing | 17,156.91 | 17,156.91 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644306 | 580417 | 8 May 2026, 11:53:38 UTC | 8 May 2026, 12:21:47 UTC | Error while computing | 1,557.08 | 1,468.08 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644316 | 503617 | 8 May 2026, 12:21:54 UTC | 10 May 2026, 16:00:21 UTC | Error while computing | 1,349.66 | 1,321.75 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644923 | 601014 | 10 May 2026, 16:00:29 UTC | 10 May 2026, 18:12:04 UTC | Error while computing | 7,895.00 | 7,897.62 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644937 | 622998 | 10 May 2026, 18:12:11 UTC | 10 May 2026, 23:38:07 UTC | Error while computing | 19,482.77 | 19,482.77 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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