Workunit 31589682
| name | shp2_A18_A04_r0_4-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND1676 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:41:25 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 |
|---|---|---|---|---|---|---|---|---|
| 38643064 | 622998 | 7 May 2026, 10:41:31 UTC | 7 May 2026, 12:45:27 UTC | Error while computing | 6,691.99 | 6,599.58 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643347 | 638061 | 7 May 2026, 12:45:38 UTC | 7 May 2026, 17:50:19 UTC | Error while computing | 8,262.88 | 8,262.88 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643707 | 637171 | 7 May 2026, 17:50:30 UTC | 7 May 2026, 23:00:35 UTC | Error while computing | 2,639.05 | 2,639.05 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643918 | 621335 | 7 May 2026, 23:00:48 UTC | 8 May 2026, 10:01:32 UTC | Error while computing | 1,651.96 | 1,523.36 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644265 | 649650 | 8 May 2026, 10:01:39 UTC | 8 May 2026, 14:10:21 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644365 | 650754 | 8 May 2026, 14:10:26 UTC | 9 May 2026, 2:34:12 UTC | Error while computing | 110.08 | 42.97 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644626 | 628467 | 9 May 2026, 2:34:16 UTC | 9 May 2026, 4:50:58 UTC | Error while computing | 1,203.84 | 1,100.52 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644655 | 641545 | 9 May 2026, 4:51:11 UTC | 9 May 2026, 5:49:15 UTC | Error while computing | 3,044.64 | 3,044.64 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644678 | 647736 | 9 May 2026, 5:49:24 UTC | 9 May 2026, 9:06:24 UTC | Error while computing | 11,686.65 | 11,497.69 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
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