Workunit 31589721
| name | shp2_A20_A23_r0_2-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND5249 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:45:16 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 |
|---|---|---|---|---|---|---|---|---|
| 38643105 | 602586 | 7 May 2026, 10:45:22 UTC | 7 May 2026, 11:04:45 UTC | Error while computing | 540.85 | 263.76 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643190 | 518555 | 7 May 2026, 11:04:57 UTC | 7 May 2026, 12:48:49 UTC | Error while computing | 5,803.50 | 5,726.20 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643354 | 609900 | 7 May 2026, 12:49:00 UTC | 7 May 2026, 16:13:22 UTC | Error while computing | 12,022.07 | 11,754.67 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643603 | 641165 | 7 May 2026, 16:13:29 UTC | 11 May 2026, 11:23:35 UTC | Error while computing | 175.95 | 164.83 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644990 | 613630 | 11 May 2026, 11:23:43 UTC | 11 May 2026, 11:40:20 UTC | Error while computing | 748.16 | 626.13 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644991 | 637595 | 11 May 2026, 11:40:25 UTC | 11 May 2026, 11:46:04 UTC | Error while computing | 245.19 | 235.75 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644992 | 647736 | 11 May 2026, 11:46:07 UTC | 11 May 2026, 13:07:47 UTC | Error while computing | 4,412.46 | 4,344.21 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644996 | 503617 | 11 May 2026, 13:07:49 UTC | 11 May 2026, 18:53:33 UTC | Error while computing | 2,803.22 | 2,784.82 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
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