Workunit 31589642
| name | shp2_A10_A23_r0_4-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND7009 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:37:30 UTC |
| minimum quorum | 1 |
| initial replication | 1 |
| max # of error/total/success tasks | 7, 10, 6 |
| errors | Too many errors (may have bug) Too many total results |
| Task click for details | Computer | Sent | Time reported or deadline explain | Status | Run time (sec) | CPU time (sec) | Credit | Application |
|---|---|---|---|---|---|---|---|---|
| 38643021 | 648916 | 7 May 2026, 10:37:37 UTC | 8 May 2026, 12:24:25 UTC | Error while computing | 71.60 | 33.05 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644318 | 637171 | 8 May 2026, 12:24:29 UTC | 8 May 2026, 14:13:11 UTC | Error while computing | 143.42 | 105.36 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644371 | 647736 | 8 May 2026, 14:13:18 UTC | 8 May 2026, 22:59:18 UTC | Error while computing | 82.47 | 49.30 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644579 | 651345 | 8 May 2026, 22:59:25 UTC | 8 May 2026, 22:59:42 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644580 | 603009 | 8 May 2026, 22:59:48 UTC | 9 May 2026, 0:34:16 UTC | Error while computing | 82.51 | 40.21 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644604 | 651763 | 9 May 2026, 0:34:24 UTC | 9 May 2026, 1:02:43 UTC | Error while computing | 227.99 | 86.23 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644610 | 652185 | 9 May 2026, 1:02:47 UTC | 9 May 2026, 5:28:49 UTC | Error while computing | 134.62 | 64.80 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644670 | 632144 | 9 May 2026, 5:29:02 UTC | 9 May 2026, 5:32:57 UTC | Error while computing | 91.22 | 34.55 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644672 | 648092 | 9 May 2026, 5:33:12 UTC | 9 May 2026, 5:33:51 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644673 | 639028 | 9 May 2026, 5:33:59 UTC | 9 May 2026, 5:42:42 UTC | Error while computing | 128.09 | 89.14 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
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