Workunit 31577306
| name | cdk8_A16_A31_r0_1-QUICO_ATM_GAFF2_NAGL_cdk8-0-6-RND2003 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 24 Apr 2026, 11:42:25 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 |
|---|---|---|---|---|---|---|---|---|
| 38627307 | 621726 | 24 Apr 2026, 11:57:51 UTC | 27 Apr 2026, 15:13:55 UTC | Error while computing | 2,551.37 | 2,366.44 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38633980 | 610880 | 27 Apr 2026, 15:14:00 UTC | 28 Apr 2026, 3:49:45 UTC | Aborted | 0.00 | 0.00 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38634483 | 651892 | 28 Apr 2026, 3:49:52 UTC | 30 Apr 2026, 1:20:55 UTC | Error while computing | 785.06 | 701.72 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38638120 | 649510 | 30 Apr 2026, 1:21:01 UTC | 30 Apr 2026, 1:32:33 UTC | Error while computing | 361.69 | 334.17 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38638134 | 573842 | 30 Apr 2026, 1:32:39 UTC | 3 May 2026, 23:00:54 UTC | Error while computing | 2,122.55 | 1,983.30 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38642012 | 590980 | 3 May 2026, 23:01:12 UTC | 4 May 2026, 2:57:12 UTC | Error while computing | 14,077.06 | 13,323.16 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38642023 | 642492 | 4 May 2026, 2:57:31 UTC | 4 May 2026, 3:28:57 UTC | Error while computing | 598.92 | 496.03 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38642025 | 648534 | 4 May 2026, 3:29:04 UTC | 4 May 2026, 3:41:06 UTC | Error while computing | 627.22 | 578.31 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38642026 | 332854 | 4 May 2026, 3:41:22 UTC | 4 May 2026, 4:43:25 UTC | Error while computing | 2,939.79 | 2,862.30 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
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