All tasks for computer 593978



State: All (7) · In progress (3) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · Invalid (0) · Error (1)
Application: All (7) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · ATMbeta: Free energy calculations of protein-ligand binding (0) · ATMML: Free energy with neural networks (0) · LLM: LLMs for chemistry (0) · LLMS: LLMs for chemistry (Small) (0) · Quantum chemistry calculations on GPU (0)
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Task
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Show names		Work unit
click for details		SentTime reported
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38583262 31547425 14 Dec 2025, 0:00:58 UTC 19 Dec 2025, 0:00:58 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38582823 31547066 13 Dec 2025, 12:33:17 UTC 18 Dec 2025, 12:33:17 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38582367 31546688 13 Dec 2025, 2:55:07 UTC 18 Dec 2025, 2:55:07 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581571 31546090 12 Dec 2025, 10:54:52 UTC 13 Dec 2025, 12:38:17 UTC Completed and validated 12,037.38 12,037.38 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581579 31546098 12 Dec 2025, 10:54:52 UTC 14 Dec 2025, 4:23:35 UTC Completed and validated 13,861.74 13,398.53 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581580 31546099 12 Dec 2025, 10:54:52 UTC 13 Dec 2025, 8:05:20 UTC Completed and validated 13,034.32 12,891.02 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580986 31545147 12 Dec 2025, 10:01:59 UTC 12 Dec 2025, 22:53:55 UTC Error while computing 25,446.80 19,976.27 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


State: All (7) · In progress (3) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · Invalid (0) · Error (1)
Application: All (7) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · ATMbeta: Free energy calculations of protein-ligand binding (0) · ATMML: Free energy with neural networks (0) · LLM: LLMs for chemistry (0) · LLMS: LLMs for chemistry (Small) (0) · Quantum chemistry calculations on GPU (0)
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