All tasks for computer 630657



State: All (6) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (5) · Invalid (0) · Error (1)
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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38583746 31547803 14 Dec 2025, 15:13:39 UTC 15 Dec 2025, 22:31:15 UTC Error while computing 103,227.32 98,408.83 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38583377 31547517 14 Dec 2025, 3:05:45 UTC 14 Dec 2025, 11:05:14 UTC Completed and validated 12,881.45 11,382.91 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38582898 31547131 13 Dec 2025, 14:27:05 UTC 14 Dec 2025, 14:13:32 UTC Completed and validated 21,970.72 21,358.34 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38582899 31547132 13 Dec 2025, 14:27:05 UTC 14 Dec 2025, 1:05:29 UTC Completed and validated 10,444.17 10,444.17 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38582818 31547061 13 Dec 2025, 12:26:47 UTC 13 Dec 2025, 23:51:46 UTC Completed and validated 22,079.14 20,664.98 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581693 31546144 12 Dec 2025, 13:14:44 UTC 12 Dec 2025, 17:16:53 UTC Completed and validated 13,827.81 13,827.81 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


State: All (6) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (5) · Invalid (0) · Error (1)
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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