Workunit 31545156
| name | JNK1_A19_A12_r0_1-QUICO_ATM_GAFF2_LOMAP_JNK1_2-0-5-RND7584 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 11 Dec 2025, 14:25:57 UTC |
| minimum quorum | 1 |
| initial replication | 1 |
| max # of error/total/success tasks | 7, 10, 6 |
| Task click for details | Computer | Sent | Time reported or deadline explain | Status | Run time (sec) | CPU time (sec) | Credit | Application |
|---|---|---|---|---|---|---|---|---|
| 38580303 | 549890 | 11 Dec 2025, 14:25:59 UTC | 11 Dec 2025, 15:51:46 UTC | Aborted | 5,044.51 | 2,663.97 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38580511 | 647216 | 11 Dec 2025, 15:51:52 UTC | 11 Dec 2025, 16:47:23 UTC | Error while computing | 80.49 | 29.39 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38580697 | 611154 | 11 Dec 2025, 16:47:27 UTC | 12 Dec 2025, 6:32:13 UTC | Aborted | 312.03 | 96.13 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38580922 | 643627 | 12 Dec 2025, 6:32:21 UTC | 12 Dec 2025, 7:25:53 UTC | Error while computing | 310.82 | 212.47 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38580942 | 621860 | 12 Dec 2025, 7:26:01 UTC | 13 Dec 2025, 14:18:08 UTC | Aborted | 1,554.18 | 697.23 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38582892 | 615763 | 13 Dec 2025, 14:18:16 UTC | 13 Dec 2025, 14:30:34 UTC | Aborted | 25.23 | 0.02 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38582904 | 638537 | 13 Dec 2025, 14:30:41 UTC | 14 Dec 2025, 1:19:17 UTC | Error while computing | 36,073.08 | 34,017.09 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38583317 | 341471 | 14 Dec 2025, 1:19:24 UTC | 14 Dec 2025, 1:28:08 UTC | Error while computing | 271.16 | 0.27 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38583321 | 645981 | 14 Dec 2025, 1:28:18 UTC | 19 Dec 2025, 1:28:18 UTC | In progress | --- | --- | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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