Workunit 31589635
| name | shp2_A09_A08_r0_2-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND4270 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:36:50 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 |
|---|---|---|---|---|---|---|---|---|
| 38643014 | 410651 | 7 May 2026, 10:36:57 UTC | 7 May 2026, 11:11:39 UTC | Error while computing | 1,348.55 | 1,043.53 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643207 | 573558 | 7 May 2026, 11:11:47 UTC | 7 May 2026, 11:18:10 UTC | Error while computing | 231.10 | 166.63 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643221 | 646146 | 7 May 2026, 11:18:18 UTC | 8 May 2026, 9:30:59 UTC | Error while computing | 156.36 | 87.58 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644255 | 485535 | 8 May 2026, 9:31:06 UTC | 9 May 2026, 9:24:03 UTC | Error while computing | 1,354.19 | 1,200.52 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644726 | 628466 | 9 May 2026, 9:24:09 UTC | 9 May 2026, 9:54:37 UTC | Error while computing | 947.63 | 656.66 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644731 | 596137 | 9 May 2026, 9:54:45 UTC | 9 May 2026, 14:14:01 UTC | Error while computing | 720.77 | 644.39 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644770 | 603009 | 9 May 2026, 14:14:04 UTC | 9 May 2026, 18:12:27 UTC | Error while computing | 241.58 | 190.96 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644808 | 648094 | 9 May 2026, 18:12:36 UTC | 9 May 2026, 18:13:10 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644809 | 651346 | 9 May 2026, 18:13:15 UTC | 9 May 2026, 18:13:49 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644810 | 649650 | 9 May 2026, 18:13:55 UTC | 9 May 2026, 18:14:29 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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