Workunit 31589667
| name | shp2_A14_A09_r0_4-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND0958 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:39:56 UTC |
| minimum quorum | 1 |
| initial replication | 1 |
| max # of error/total/success tasks | 7, 10, 6 |
| errors | Too many total results |
| Task click for details | Computer | Sent | Time reported or deadline explain | Status | Run time (sec) | CPU time (sec) | Credit | Application |
|---|---|---|---|---|---|---|---|---|
| 38643048 | 643524 | 7 May 2026, 10:40:12 UTC | 7 May 2026, 12:47:58 UTC | Error while computing | 193.96 | 3.34 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643350 | 630817 | 7 May 2026, 12:48:09 UTC | 7 May 2026, 13:15:27 UTC | Error while computing | 1,553.26 | 1,413.66 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643389 | 610902 | 7 May 2026, 13:15:30 UTC | 9 May 2026, 10:02:03 UTC | Error while computing | 9,295.56 | 8,009.02 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644733 | 604231 | 9 May 2026, 10:02:11 UTC | 9 May 2026, 10:13:45 UTC | Error while computing | 498.42 | 475.38 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644737 | 562435 | 9 May 2026, 10:13:58 UTC | 9 May 2026, 11:45:59 UTC | Error while computing | 4,424.28 | 3,594.56 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644751 | 550955 | 9 May 2026, 11:46:06 UTC | 9 May 2026, 16:34:05 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644798 | 651346 | 9 May 2026, 16:34:13 UTC | 9 May 2026, 16:34:47 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644799 | 652201 | 9 May 2026, 16:34:56 UTC | 9 May 2026, 22:53:34 UTC | Aborted | 6.10 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644830 | 652526 | 9 May 2026, 22:53:36 UTC | 10 May 2026, 7:22:19 UTC | Error while computing | 1,383.40 | 1,383.40 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644863 | 613630 | 10 May 2026, 7:22:27 UTC | 10 May 2026, 8:14:40 UTC | Error while computing | 1,504.76 | 1,285.69 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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