Workunit 31589602
| name | shp2_A03_A13_r0_4-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND9267 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:33:30 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 |
|---|---|---|---|---|---|---|---|---|
| 38642981 | 628418 | 7 May 2026, 10:33:41 UTC | 8 May 2026, 4:38:08 UTC | Error while computing | 2,228.30 | 2,228.30 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644115 | 641444 | 8 May 2026, 4:38:13 UTC | 8 May 2026, 9:51:49 UTC | Error while computing | 4,453.75 | 4,130.53 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644261 | 628466 | 8 May 2026, 9:51:58 UTC | 8 May 2026, 13:41:39 UTC | Error while computing | 13,781.00 | 14,682.70 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644347 | 506550 | 8 May 2026, 13:41:51 UTC | 8 May 2026, 14:20:01 UTC | Error while computing | 870.46 | 761.55 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644380 | 648066 | 8 May 2026, 14:20:06 UTC | 9 May 2026, 4:54:16 UTC | Error while computing | 145.40 | 101.09 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644658 | 651345 | 9 May 2026, 4:54:22 UTC | 9 May 2026, 4:54:56 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644659 | 625602 | 9 May 2026, 4:55:05 UTC | 9 May 2026, 20:26:37 UTC | Error while computing | 8,565.16 | 8,565.16 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644817 | 648094 | 9 May 2026, 20:26:45 UTC | 9 May 2026, 20:27:22 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644818 | 652526 | 9 May 2026, 20:27:30 UTC | 9 May 2026, 20:33:03 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644819 | 557889 | 9 May 2026, 20:33:13 UTC | 9 May 2026, 21:13:54 UTC | Error while computing | 723.53 | 672.27 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
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