Workunit 31545081
| name | JNK1_A25_A38_r0_1-QUICO_ATM_GAFF2_LOMAP_JNK1-0-5-RND0947 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 11 Dec 2025, 13:19:27 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 |
|---|---|---|---|---|---|---|---|---|
| 38579765 | 629033 | 11 Dec 2025, 13:19:35 UTC | 11 Dec 2025, 13:28:21 UTC | Error while computing | 130.31 | 16.22 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38579923 | 645105 | 11 Dec 2025, 13:28:27 UTC | 11 Dec 2025, 14:29:45 UTC | Error while computing | 70.58 | 8.14 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38580360 | 635604 | 11 Dec 2025, 14:29:54 UTC | 11 Dec 2025, 14:31:29 UTC | Error while computing | 68.77 | 18.85 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38580389 | 590406 | 11 Dec 2025, 14:31:34 UTC | 11 Dec 2025, 14:35:12 UTC | Error while computing | 99.67 | 18.08 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38580438 | 633620 | 11 Dec 2025, 14:35:21 UTC | 13 Dec 2025, 21:24:35 UTC | Error while computing | 78.09 | 23.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38583168 | 611154 | 13 Dec 2025, 21:24:47 UTC | 14 Dec 2025, 6:21:09 UTC | Error while computing | 117.54 | 7.74 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38583478 | 647027 | 14 Dec 2025, 6:21:16 UTC | 14 Dec 2025, 19:49:10 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38583852 | 648130 | 14 Dec 2025, 19:49:17 UTC | 14 Dec 2025, 20:08:07 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38583857 | 625602 | 14 Dec 2025, 20:08:10 UTC | 14 Dec 2025, 22:55:40 UTC | Error while computing | 70.82 | 12.94 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38583919 | 549890 | 14 Dec 2025, 22:55:48 UTC | 14 Dec 2025, 23:30:31 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
©2025 Universitat Pompeu Fabra