All tasks for computer 651329



State: All (9) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (7) · 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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38626997 31577037 24 Apr 2026, 10:46:26 UTC 29 Apr 2026, 10:46:26 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38626291 31576397 24 Apr 2026, 9:08:18 UTC 24 Apr 2026, 10:52:19 UTC Completed and validated 6,043.79 6,043.79 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38625347 31575581 23 Apr 2026, 14:42:50 UTC 23 Apr 2026, 17:42:35 UTC Completed and validated 10,306.21 10,306.21 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38623222 31573868 21 Apr 2026, 8:19:33 UTC 21 Apr 2026, 10:06:49 UTC Completed and validated 5,839.66 5,839.66 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38621857 31572699 20 Apr 2026, 11:51:27 UTC 20 Apr 2026, 15:27:10 UTC Completed and validated 12,445.25 12,445.25 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38621317 31572204 20 Apr 2026, 8:52:18 UTC 20 Apr 2026, 12:01:55 UTC Completed and validated 10,760.63 10,760.63 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38620892 31571989 19 Apr 2026, 13:20:35 UTC 20 Apr 2026, 9:20:40 UTC Completed and validated 10,429.28 10,429.28 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38620698 31563839 19 Apr 2026, 11:17:37 UTC 19 Apr 2026, 11:54:16 UTC Error while computing 2,139.10 2,139.10 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38620340 31560051 19 Apr 2026, 7:53:07 UTC 19 Apr 2026, 11:07:57 UTC Completed and validated 11,401.01 11,401.01 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (9) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (7) · 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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