All tasks for computer 557889



State: All (10) · In progress (2) · Validation pending (0) · Validation inconclusive (0) · Valid (6) · Invalid (0) · Error (2)
Application: All (10) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (10) · 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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38595519 31551822 9 Feb 2026, 19:43:04 UTC 10 Feb 2026, 9:30:51 UTC Cancelled by server 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38595514 31551948 9 Feb 2026, 19:04:26 UTC 14 Feb 2026, 19:04:26 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38595498 31551941 9 Feb 2026, 13:22:10 UTC 14 Feb 2026, 13:22:10 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38595284 31551820 6 Feb 2026, 5:27:27 UTC 10 Feb 2026, 14:24:21 UTC Completed and validated 186,567.20 94,488.97 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38595282 31551706 6 Feb 2026, 4:48:45 UTC 9 Feb 2026, 13:21:37 UTC Completed and validated 188,012.53 97,708.71 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38595281 31551860 6 Feb 2026, 4:29:56 UTC 8 Feb 2026, 10:34:56 UTC Completed and validated 190,372.31 102,330.80 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38594957 31551401 3 Feb 2026, 16:10:44 UTC 5 Feb 2026, 23:03:09 UTC Error while computing 6,608.74 6,549.69 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38594955 31551613 3 Feb 2026, 15:50:39 UTC 7 Feb 2026, 9:07:41 UTC Completed and validated 121,364.00 65,767.97 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38594948 31551452 3 Feb 2026, 14:49:42 UTC 5 Feb 2026, 21:13:05 UTC Completed and validated 193,478.63 105,231.80 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38594501 31551680 31 Jan 2026, 8:59:47 UTC 5 Feb 2026, 3:31:38 UTC Completed and validated 163,111.76 87,562.14 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (10) · In progress (2) · Validation pending (0) · Validation inconclusive (0) · Valid (6) · Invalid (0) · Error (2)
Application: All (10) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (10) · 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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