All tasks for computer 606875



State: All (9) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (8) · Invalid (0) · Error (1)
Application: All (9) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (9) · 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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38584886 31548375 18 Dec 2025, 5:12:34 UTC 18 Dec 2025, 9:40:08 UTC Completed and validated 16,054.00 16,080.11 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38584571 31548124 17 Dec 2025, 18:39:59 UTC 18 Dec 2025, 3:08:40 UTC Completed and validated 17,408.38 17,408.38 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38584453 31548014 17 Dec 2025, 16:39:46 UTC 17 Dec 2025, 22:21:09 UTC Completed and validated 13,234.84 13,234.84 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38584454 31548015 17 Dec 2025, 16:39:46 UTC 17 Dec 2025, 18:42:53 UTC Completed and validated 7,326.77 7,326.77 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38584357 31545830 17 Dec 2025, 10:55:15 UTC 17 Dec 2025, 10:57:58 UTC Error while computing 36.25 0.81 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581328 31545853 12 Dec 2025, 10:45:21 UTC 12 Dec 2025, 14:36:32 UTC Completed and validated 6,876.26 6,876.26 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581329 31545854 12 Dec 2025, 10:45:21 UTC 12 Dec 2025, 18:24:53 UTC Completed and validated 6,859.47 6,859.47 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581336 31545861 12 Dec 2025, 10:45:21 UTC 12 Dec 2025, 12:42:59 UTC Completed and validated 7,058.00 7,061.62 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581341 31545866 12 Dec 2025, 10:45:21 UTC 12 Dec 2025, 16:31:24 UTC Completed and validated 6,954.19 6,954.19 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (9) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (8) · Invalid (0) · Error (1)
Application: All (9) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (9) · 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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