All tasks for computer 648995



State: All (7) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (5)
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
38617150 31567947 18 Apr 2026, 2:02:28 UTC 23 Apr 2026, 2:02:28 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38614179 31566562 17 Apr 2026, 10:02:55 UTC 17 Apr 2026, 16:54:03 UTC Error while computing 4,259.56 4,259.56 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38614180 31564285 17 Apr 2026, 10:02:55 UTC 17 Apr 2026, 13:48:18 UTC Error while computing 6,160.80 6,160.80 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38610452 31563352 15 Apr 2026, 10:01:46 UTC 15 Apr 2026, 10:17:15 UTC Error while computing 698.09 698.09 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38610453 31557300 15 Apr 2026, 10:01:46 UTC 15 Apr 2026, 14:18:11 UTC Error while computing 8,191.72 8,191.72 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38608136 31561554 14 Apr 2026, 15:10:29 UTC 14 Apr 2026, 23:00:30 UTC Error while computing 40.49 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38599439 31554349 8 Apr 2026, 17:52:43 UTC 11 Apr 2026, 21:53:03 UTC Completed and validated 5,892.97 5,892.97 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


State: All (7) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (5)
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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