Workunit 31589756
| name | shp2_A25_A16_r0_2-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND3196 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:48:30 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 |
|---|---|---|---|---|---|---|---|---|
| 38643144 | 609629 | 7 May 2026, 10:48:36 UTC | 7 May 2026, 11:48:04 UTC | Error while computing | 1,520.71 | 1,416.66 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643273 | 637595 | 7 May 2026, 11:48:23 UTC | 7 May 2026, 14:34:06 UTC | Error while computing | 317.91 | 317.91 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643462 | 626541 | 7 May 2026, 14:34:21 UTC | 7 May 2026, 15:32:28 UTC | Error while computing | 2,035.91 | 1,483.83 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643552 | 649506 | 7 May 2026, 15:32:34 UTC | 10 May 2026, 6:03:06 UTC | Error while computing | 10,863.35 | 10,826.16 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644856 | 503617 | 10 May 2026, 6:03:12 UTC | 11 May 2026, 13:33:33 UTC | Error while computing | 932.90 | 889.40 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644998 | 557889 | 11 May 2026, 13:33:35 UTC | 11 May 2026, 13:45:28 UTC | Error while computing | 678.88 | 630.74 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644999 | 652554 | 11 May 2026, 13:45:30 UTC | 11 May 2026, 14:05:04 UTC | Error while computing | 1,174.00 | 1,456.86 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38645000 | 619022 | 11 May 2026, 14:05:12 UTC | 11 May 2026, 14:42:23 UTC | Error while computing | 1,552.98 | 1,345.59 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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