Workunit 31589746
| name | shp2_A22_A13_r0_2-QUICO_ATM_OpenFF23_NAGL_shp2-0-6-RND5051 |
| application | ATM: Free energy calculations of protein-ligand binding |
| created | 7 May 2026, 10:47:37 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 |
|---|---|---|---|---|---|---|---|---|
| 38643132 | 652228 | 7 May 2026, 10:47:51 UTC | 7 May 2026, 10:56:58 UTC | Error while computing | 273.31 | 146.27 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38643171 | 604216 | 7 May 2026, 10:57:12 UTC | 8 May 2026, 1:01:21 UTC | Error while computing | 3,077.70 | 3,007.80 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644006 | 627746 | 8 May 2026, 1:01:27 UTC | 8 May 2026, 1:23:00 UTC | Error while computing | 105.83 | 105.83 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644020 | 637171 | 8 May 2026, 1:23:09 UTC | 8 May 2026, 6:47:53 UTC | Error while computing | 1,049.36 | 1,049.36 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
| 38644176 | 506550 | 8 May 2026, 6:48:02 UTC | 8 May 2026, 8:53:41 UTC | Error while computing | 1,264.44 | 1,202.27 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644235 | 485535 | 8 May 2026, 8:53:44 UTC | 9 May 2026, 9:01:50 UTC | Error while computing | 5,625.37 | 5,290.64 | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) windows_x86_64 |
| 38644722 | 649514 | 9 May 2026, 9:01:56 UTC | 14 May 2026, 9:01:56 UTC | In progress | --- | --- | --- | ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121) x86_64-pc-linux-gnu |
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