All tasks for computer 627729



State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (4) · Invalid (0) · Error (1)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (5) · 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
38584759 31545063 17 Dec 2025, 23:41:00 UTC 17 Dec 2025, 23:46:27 UTC Error while computing 46.39 1.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581589 31545747 12 Dec 2025, 10:58:36 UTC 13 Dec 2025, 0:56:15 UTC Completed and validated 16,606.13 15,958.77 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581590 31545749 12 Dec 2025, 10:58:36 UTC 12 Dec 2025, 15:42:11 UTC Completed and validated 16,465.86 15,885.13 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581591 31545750 12 Dec 2025, 10:58:36 UTC 13 Dec 2025, 5:29:53 UTC Completed and validated 16,414.36 15,890.96 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581592 31545755 12 Dec 2025, 10:58:36 UTC 12 Dec 2025, 20:19:05 UTC Completed and validated 16,629.40 16,117.10 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (4) · Invalid (0) · Error (1)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (5) · 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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