Workunit 31589647
| name | shp2_A11_A13_r0_4-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND2687 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:38:02 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 |
|---|---|---|---|---|---|---|---|---|
| 38643026 | 614877 | 7 May 2026, 10:38:15 UTC | 7 May 2026, 23:11:18 UTC | Error while computing | 10,228.38 | 9,880.52 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643927 | 648117 | 7 May 2026, 23:11:26 UTC | 7 May 2026, 23:18:35 UTC | Error while computing | 287.23 | 202.03 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643934 | 649987 | 7 May 2026, 23:18:47 UTC | 8 May 2026, 2:12:31 UTC | Error while computing | 10,424.00 | 10,671.33 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644052 | 611154 | 8 May 2026, 2:12:36 UTC | 8 May 2026, 7:44:11 UTC | Error while computing | 870.46 | 867.48 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644209 | 639894 | 8 May 2026, 7:44:17 UTC | 10 May 2026, 16:13:07 UTC | Error while computing | 142.15 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644924 | 549890 | 10 May 2026, 16:13:13 UTC | 10 May 2026, 20:27:07 UTC | Error while computing | 15,234.00 | 15,403.54 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644944 | 604216 | 10 May 2026, 20:27:15 UTC | 11 May 2026, 6:36:31 UTC | Error while computing | 12,955.64 | 12,877.78 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644983 | 652526 | 11 May 2026, 6:36:41 UTC | 11 May 2026, 7:12:47 UTC | Error while computing | 2,166.00 | 2,332.11 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
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