Workunit 31589732
| name | shp2_A21_A07_r0_3-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND3729 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:46:18 UTC |
| minimum quorum | 1 |
| initial replication | 1 |
| max # of error/total/success tasks | 7, 10, 6 |
| errors | Too many errors (may have bug) |
| Task click for details | Computer | Sent | Time reported or deadline explain | Status | Run time (sec) | CPU time (sec) | Credit | Application |
|---|---|---|---|---|---|---|---|---|
| 38643116 | 648066 | 7 May 2026, 10:46:27 UTC | 7 May 2026, 17:24:50 UTC | Error while computing | 409.01 | 361.94 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643680 | 639933 | 7 May 2026, 17:24:57 UTC | 7 May 2026, 17:35:39 UTC | Error while computing | 417.70 | 269.08 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643693 | 628467 | 7 May 2026, 17:35:41 UTC | 7 May 2026, 19:16:54 UTC | Error while computing | 1,266.38 | 1,114.56 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643778 | 648465 | 7 May 2026, 19:16:59 UTC | 7 May 2026, 19:19:48 UTC | Error while computing | 66.22 | 30.07 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643781 | 648092 | 7 May 2026, 19:19:59 UTC | 7 May 2026, 19:20:15 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643782 | 584054 | 7 May 2026, 19:20:25 UTC | 7 May 2026, 19:51:56 UTC | Error while computing | 1,637.07 | 1,600.30 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643811 | 464555 | 7 May 2026, 19:52:14 UTC | 7 May 2026, 19:56:24 UTC | Error while computing | 133.83 | 63.44 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643817 | 623141 | 7 May 2026, 19:56:38 UTC | 7 May 2026, 20:32:07 UTC | Error while computing | 1,147.95 | 1,045.44 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643835 | 629577 | 7 May 2026, 20:32:16 UTC | 7 May 2026, 20:39:14 UTC | Error while computing | 311.20 | 269.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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