Workunit 31589731
| name | shp2_A21_A07_r0_2-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND8743 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:46:15 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 |
|---|---|---|---|---|---|---|---|---|
| 38643115 | 648066 | 7 May 2026, 10:46:27 UTC | 7 May 2026, 17:33:19 UTC | Error while computing | 520.23 | 481.21 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38643687 | 186626 | 7 May 2026, 17:33:23 UTC | 8 May 2026, 2:06:40 UTC | Error while computing | 452.94 | 400.60 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644050 | 619497 | 8 May 2026, 2:06:45 UTC | 8 May 2026, 2:23:33 UTC | Error while computing | 901.51 | 759.13 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644057 | 617857 | 8 May 2026, 2:23:40 UTC | 8 May 2026, 2:27:52 UTC | Error while computing | 133.95 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644061 | 652202 | 8 May 2026, 2:28:00 UTC | 8 May 2026, 19:54:18 UTC | Error while computing | 243.49 | 188.17 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644505 | 601014 | 8 May 2026, 19:54:24 UTC | 8 May 2026, 20:18:03 UTC | Error while computing | 194.66 | 158.86 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644512 | 604231 | 8 May 2026, 20:18:05 UTC | 8 May 2026, 20:24:09 UTC | Error while computing | 116.38 | 89.05 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644519 | 648092 | 8 May 2026, 20:24:16 UTC | 8 May 2026, 20:24:49 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644520 | 651346 | 8 May 2026, 20:24:56 UTC | 8 May 2026, 20:25:13 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644521 | 651945 | 8 May 2026, 20:25:18 UTC | 8 May 2026, 20:32:26 UTC | Error while computing | 322.26 | 204.50 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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