Workunit 31589763
| name | shp2_A26_A17_r0_4-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND4430 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:49:11 UTC |
| minimum quorum | 1 |
| initial replication | 1 |
| max # of error/total/success tasks | 7, 10, 6 |
| Task click for details | Computer | Sent | Time reported or deadline explain | Status | Run time (sec) | CPU time (sec) | Credit | Application |
|---|---|---|---|---|---|---|---|---|
| 38643151 | 585486 | 7 May 2026, 10:50:08 UTC | 8 May 2026, 3:05:28 UTC | Error while computing | 5,397.09 | 5,397.09 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644079 | 610687 | 8 May 2026, 3:05:47 UTC | 8 May 2026, 4:40:56 UTC | Error while computing | 3,978.41 | 3,978.41 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644117 | 626715 | 8 May 2026, 4:40:58 UTC | 8 May 2026, 5:07:59 UTC | Error while computing | 817.93 | 699.36 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644123 | 550955 | 8 May 2026, 5:08:05 UTC | 9 May 2026, 4:40:59 UTC | Error while computing | 2,121.11 | 2,121.11 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644647 | 604231 | 9 May 2026, 4:41:07 UTC | 9 May 2026, 4:48:14 UTC | Error while computing | 275.84 | 253.77 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644652 | 649650 | 9 May 2026, 4:48:22 UTC | 9 May 2026, 4:49:17 UTC | Aborted | 17.17 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644654 | 611154 | 9 May 2026, 4:49:22 UTC | 9 May 2026, 5:55:55 UTC | Error while computing | 3,993.00 | 4,144.08 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644681 | 618582 | 9 May 2026, 5:55:59 UTC | 9 May 2026, 6:48:28 UTC | Error while computing | 1,662.25 | 1,651.19 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644688 | 637171 | 9 May 2026, 6:48:35 UTC | 9 May 2026, 7:19:45 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644692 | 652185 | 9 May 2026, 7:19:50 UTC | 14 May 2026, 7:19:50 UTC | In progress | --- | --- | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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