Workunit 31589679
| name | shp2_A18_A04_r0_1-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND8993 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:41:15 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 |
|---|---|---|---|---|---|---|---|---|
| 38643060 | 648916 | 7 May 2026, 10:41:21 UTC | 8 May 2026, 14:41:40 UTC | Error while computing | 8,903.07 | 8,903.07 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644392 | 651346 | 8 May 2026, 14:41:47 UTC | 8 May 2026, 14:42:20 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644394 | 611154 | 8 May 2026, 14:42:22 UTC | 8 May 2026, 21:39:34 UTC | Error while computing | 12,853.96 | 12,853.96 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644549 | 641455 | 8 May 2026, 21:39:43 UTC | 9 May 2026, 14:09:23 UTC | Error while computing | 357.57 | 149.08 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644769 | 652201 | 9 May 2026, 14:09:29 UTC | 9 May 2026, 14:58:28 UTC | Error while computing | 342.72 | 217.05 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644785 | 485535 | 9 May 2026, 14:58:31 UTC | 10 May 2026, 8:30:06 UTC | Error while computing | 8,071.58 | 7,669.70 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644871 | 651345 | 10 May 2026, 8:30:18 UTC | 10 May 2026, 8:30:55 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644872 | 649650 | 10 May 2026, 8:30:59 UTC | 10 May 2026, 8:31:37 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644873 | 651954 | 10 May 2026, 8:31:47 UTC | 10 May 2026, 9:56:21 UTC | Error while computing | 416.93 | 305.65 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644895 | 648094 | 10 May 2026, 9:56:26 UTC | 10 May 2026, 9:56:59 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
©2026 Universitat Pompeu Fabra