All tasks for computer 569442



State: All (7) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · Invalid (0) · Error (4)
Application: All (7) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · 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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38644546 31589646 8 May 2026, 21:29:16 UTC 9 May 2026, 21:04:15 UTC Error while computing 13,794.61 13,714.79 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644537 31589593 8 May 2026, 21:12:51 UTC 9 May 2026, 17:14:36 UTC Error while computing 10,644.01 10,572.09 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644531 31590049 8 May 2026, 20:55:00 UTC 9 May 2026, 17:33:16 UTC Completed and validated 52,939.51 52,631.61 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644473 31590029 8 May 2026, 17:52:00 UTC 9 May 2026, 14:16:51 UTC Completed and validated 69,808.80 69,503.13 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38643839 31589673 7 May 2026, 20:41:07 UTC 8 May 2026, 14:15:53 UTC Error while computing 10,375.34 10,285.18 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38643823 31589583 7 May 2026, 20:03:52 UTC 9 May 2026, 2:50:49 UTC Completed and validated 28,757.30 28,574.29 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38642997 31589618 7 May 2026, 10:35:17 UTC 8 May 2026, 7:36:10 UTC Error while computing 1,389.06 1,340.87 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (7) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · Invalid (0) · Error (4)
Application: All (7) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · 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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