All tasks for computer 617224



State: All (6) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · Invalid (0) · Error (2)
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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Show names		Work unit
click for details		SentTime reported
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38642037 31584882 4 May 2026, 8:57:32 UTC 9 May 2026, 8:57:32 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38638039 31585920 30 Apr 2026, 0:08:53 UTC 5 May 2026, 0:08:53 UTC Timed out - no response 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38637583 31585550 29 Apr 2026, 18:12:07 UTC 29 Apr 2026, 23:58:33 UTC Completed and validated 20,786.00 21,109.85 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38637305 31585365 29 Apr 2026, 14:41:04 UTC 29 Apr 2026, 18:12:23 UTC Completed and validated 12,679.00 12,831.00 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38637212 31585285 29 Apr 2026, 14:26:41 UTC 29 Apr 2026, 14:31:47 UTC Error while computing 156.57 130.69 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38636037 31584356 28 Apr 2026, 22:14:56 UTC 29 Apr 2026, 0:20:01 UTC Completed and validated 7,505.00 7,533.26 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (6) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · Invalid (0) · Error (2)
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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