All tasks for computer 514581



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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38637767 31585705 29 Apr 2026, 20:31:53 UTC 29 Apr 2026, 20:40:33 UTC Error while computing 300.63 240.14 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38637300 31585188 29 Apr 2026, 14:37:22 UTC 29 Apr 2026, 20:25:21 UTC Error while computing 120.23 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38637051 31585133 29 Apr 2026, 13:39:21 UTC 29 Apr 2026, 20:21:01 UTC Error while computing 6,626.59 6,626.59 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38635550 31583979 28 Apr 2026, 13:56:59 UTC 29 Apr 2026, 18:27:21 UTC Completed and validated 13,662.72 13,662.72 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38635099 31583575 28 Apr 2026, 12:56:51 UTC 29 Apr 2026, 13:39:21 UTC Error while computing 1,052.06 1,052.06 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38635162 31583637 28 Apr 2026, 12:56:51 UTC 29 Apr 2026, 11:25:31 UTC Completed and validated 22,557.45 21,868.05 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38633987 31582635 27 Apr 2026, 15:19:19 UTC 29 Apr 2026, 0:40:39 UTC Completed and validated 38,788.69 38,788.69 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


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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