All tasks for computer 646363



State: All (6) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (4)
Application: All (6) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (6) · 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
38583151 31547335 13 Dec 2025, 20:47:59 UTC 18 Dec 2025, 20:47:59 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581202 31545728 12 Dec 2025, 10:38:49 UTC 13 Dec 2025, 4:02:44 UTC Completed and validated 55,467.52 55,467.52 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580861 31545038 12 Dec 2025, 2:27:49 UTC 12 Dec 2025, 2:47:05 UTC Error while computing 140.23 25.25 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580408 31545237 11 Dec 2025, 14:32:54 UTC 11 Dec 2025, 17:16:04 UTC Aborted 3,883.10 3,826.58 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580252 31545020 11 Dec 2025, 14:23:20 UTC 11 Dec 2025, 14:32:54 UTC Error while computing 124.07 27.75 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580210 31545006 11 Dec 2025, 14:11:59 UTC 11 Dec 2025, 14:23:06 UTC Error while computing 127.80 29.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


State: All (6) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (4)
Application: All (6) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (6) · 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)
Task name:



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