All tasks for computer 601458



State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (4)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (4) · ATMbeta: Free energy calculations of protein-ligand binding (0) · ATMML: Free energy with neural networks (1) · LLM: LLMs for chemistry (0) · LLMS: LLMs for chemistry (Small) (0) · Quantum chemistry calculations on GPU (0)
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38583204 31545963 13 Dec 2025, 22:22:52 UTC 14 Dec 2025, 13:14:27 UTC Error while computing 104.46 1.59 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38582052 31546422 12 Dec 2025, 19:53:03 UTC 14 Dec 2025, 13:17:28 UTC Completed and validated 148,326.99 147,916.20 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580858 31545105 12 Dec 2025, 2:19:02 UTC 12 Dec 2025, 2:24:15 UTC Error while computing 177.65 32.22 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38580000 31545052 11 Dec 2025, 13:37:49 UTC 11 Dec 2025, 13:42:35 UTC Error while computing 155.34 20.98 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38384803 31438503 14 Feb 2025, 1:04:20 UTC 19 Feb 2025, 1:04:20 UTC Timed out - no response 0.00 0.00 --- ATMML: Free energy with neural networks v1.01 (cuda1121)
windows_x86_64


State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (4)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (4) · ATMbeta: Free energy calculations of protein-ligand binding (0) · ATMML: Free energy with neural networks (1) · LLM: LLMs for chemistry (0) · LLMS: LLMs for chemistry (Small) (0) · Quantum chemistry calculations on GPU (0)
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