All tasks for computer 651329



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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38601225 31555833 9 Apr 2026, 11:42:20 UTC 9 Apr 2026, 14:44:31 UTC Completed and validated 10,298.84 10,298.84 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38599377 31554306 8 Apr 2026, 17:21:25 UTC 9 Apr 2026, 11:35:19 UTC Completed and validated 9,740.29 9,740.29 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38599097 31554086 8 Apr 2026, 14:59:47 UTC 8 Apr 2026, 17:44:18 UTC Completed and validated 9,871.00 9,985.84 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598908 31553933 8 Apr 2026, 13:12:12 UTC 8 Apr 2026, 15:02:56 UTC Completed and validated 5,510.47 5,510.47 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598877 31553374 8 Apr 2026, 13:03:55 UTC 8 Apr 2026, 13:09:56 UTC Error while computing 28.20 0.12 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598159 31553294 8 Apr 2026, 9:13:05 UTC 8 Apr 2026, 13:08:14 UTC Completed and validated 13,473.32 13,473.32 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


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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