Workunit 31589740
| name | shp2_A22_A05_r0_1-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND4115 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:47:01 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 |
|---|---|---|---|---|---|---|---|---|
| 38643124 | 649352 | 7 May 2026, 10:47:07 UTC | 7 May 2026, 13:23:07 UTC | Error while computing | 240.65 | 132.22 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643398 | 652376 | 7 May 2026, 13:23:11 UTC | 7 May 2026, 14:53:14 UTC | Error while computing | 5,311.15 | 5,136.19 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643489 | 631341 | 7 May 2026, 14:53:29 UTC | 7 May 2026, 15:22:18 UTC | Error while computing | 1,280.66 | 1,222.59 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643530 | 648092 | 7 May 2026, 15:22:24 UTC | 7 May 2026, 15:22:41 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643531 | 627984 | 7 May 2026, 15:22:54 UTC | 7 May 2026, 19:33:30 UTC | Error while computing | 6,880.30 | 6,880.30 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643796 | 591854 | 7 May 2026, 19:33:46 UTC | 7 May 2026, 22:07:07 UTC | Error while computing | 4,826.80 | 4,657.86 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643885 | 645099 | 7 May 2026, 22:07:15 UTC | 7 May 2026, 23:32:28 UTC | Error while computing | 1,268.47 | 1,266.64 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643950 | 541192 | 7 May 2026, 23:32:35 UTC | 7 May 2026, 23:58:55 UTC | Error while computing | 232.75 | 158.20 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643965 | 573471 | 7 May 2026, 23:59:00 UTC | 8 May 2026, 4:25:51 UTC | Error while computing | 12,115.71 | 11,997.34 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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