All tasks for computer 652554



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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38645070 31590122 12 May 2026, 8:09:18 UTC 12 May 2026, 12:38:48 UTC Error while computing 15,809.27 15,809.27 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644999 31589756 11 May 2026, 13:45:30 UTC 11 May 2026, 14:05:04 UTC Error while computing 1,174.00 1,456.86 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644979 31590151 11 May 2026, 4:57:58 UTC 11 May 2026, 12:23:00 UTC Completed and validated 26,702.00 31,928.33 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644957 31589764 10 May 2026, 22:34:22 UTC 11 May 2026, 4:54:58 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644927 31590140 10 May 2026, 16:37:05 UTC 11 May 2026, 7:21:15 UTC Completed and validated 53,050.00 64,296.53 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644916 31589697 10 May 2026, 14:11:00 UTC 10 May 2026, 15:10:36 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644904 31590136 10 May 2026, 12:17:59 UTC 10 May 2026, 17:39:03 UTC Completed and validated 19,264.00 32,814.51 750,000.00 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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