Workunit 31589646
| name | shp2_A11_A13_r0_3-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND7692 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:38:00 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 |
|---|---|---|---|---|---|---|---|---|
| 38643025 | 634518 | 7 May 2026, 10:38:10 UTC | 7 May 2026, 10:48:02 UTC | Error while computing | 107.09 | 70.70 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643138 | 647993 | 7 May 2026, 10:48:14 UTC | 7 May 2026, 13:21:39 UTC | Error while computing | 2,345.52 | 2,108.66 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643396 | 648092 | 7 May 2026, 13:21:46 UTC | 7 May 2026, 13:22:19 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643397 | 627984 | 7 May 2026, 13:22:26 UTC | 7 May 2026, 17:40:05 UTC | Error while computing | 3,532.53 | 3,532.53 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643699 | 549473 | 7 May 2026, 17:40:10 UTC | 7 May 2026, 18:20:16 UTC | Error while computing | 474.85 | 331.64 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643740 | 609955 | 7 May 2026, 18:20:30 UTC | 8 May 2026, 17:43:29 UTC | Error while computing | 4,867.00 | 4,786.06 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644469 | 650215 | 8 May 2026, 17:43:36 UTC | 8 May 2026, 21:01:41 UTC | Error while computing | 2,364.92 | 2,355.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644533 | 651346 | 8 May 2026, 21:01:51 UTC | 8 May 2026, 21:02:24 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644534 | 652265 | 8 May 2026, 21:02:31 UTC | 8 May 2026, 21:29:10 UTC | Error while computing | 1,475.25 | 1,291.97 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644546 | 569442 | 8 May 2026, 21:29:16 UTC | 9 May 2026, 21:04:15 UTC | Error while computing | 13,794.61 | 13,714.79 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
©2026 Universitat Pompeu Fabra