All tasks for computer 524922



State: All (11) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (9) · Invalid (0) · Error (1)
Application: All (11) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (11) · 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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38632298 31581218 26 Apr 2026, 10:02:51 UTC 1 May 2026, 10:02:51 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38631098 31580250 25 Apr 2026, 19:24:19 UTC 26 Apr 2026, 5:34:58 UTC Completed and validated 36,639.00 37,284.87 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38630592 31579840 25 Apr 2026, 14:36:30 UTC 25 Apr 2026, 17:29:35 UTC Completed and validated 10,385.00 10,706.44 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38630184 31579519 25 Apr 2026, 11:07:24 UTC 25 Apr 2026, 14:36:30 UTC Completed and validated 12,546.00 12,860.88 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38629044 31578595 25 Apr 2026, 0:39:46 UTC 25 Apr 2026, 11:07:24 UTC Completed and validated 37,658.00 37,932.03 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38628216 31577902 24 Apr 2026, 16:57:04 UTC 25 Apr 2026, 0:39:46 UTC Completed and validated 27,762.00 28,081.07 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38628208 31577795 24 Apr 2026, 16:54:10 UTC 24 Apr 2026, 16:57:04 UTC Error while computing 55.27 13.57 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38626094 31576202 24 Apr 2026, 8:56:35 UTC 24 Apr 2026, 16:46:35 UTC Completed and validated 28,200.00 28,576.09 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38624885 31575224 23 Apr 2026, 8:43:23 UTC 23 Apr 2026, 22:43:37 UTC Completed and validated 50,414.00 51,230.92 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38623587 31574174 21 Apr 2026, 17:01:18 UTC 22 Apr 2026, 3:45:06 UTC Completed and validated 38,628.00 39,106.31 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38622023 31572850 20 Apr 2026, 13:02:04 UTC 20 Apr 2026, 23:57:28 UTC Completed and validated 39,324.00 39,806.40 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (11) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (9) · Invalid (0) · Error (1)
Application: All (11) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (11) · 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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