All tasks for computer 595174


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State: All (36) · In progress (4) · Validation pending (0) · Validation inconclusive (0) · Valid (6) · Invalid (0) · Error (26)
Application: All (36) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (36) · 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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Show names		Work unit
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38583926 31547918 14 Dec 2025, 23:13:19 UTC 19 Dec 2025, 23:13:19 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583892 31547899 14 Dec 2025, 22:04:58 UTC 19 Dec 2025, 22:04:58 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583887 31547895 14 Dec 2025, 21:43:19 UTC 19 Dec 2025, 21:43:19 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583536 31547639 14 Dec 2025, 8:08:03 UTC 19 Dec 2025, 8:08:03 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583528 31547635 14 Dec 2025, 7:57:48 UTC 14 Dec 2025, 21:31:11 UTC Error while computing 57.58 11.92 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583525 31547633 14 Dec 2025, 7:51:50 UTC 14 Dec 2025, 20:51:03 UTC Error while computing 292.26 1.29 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583345 31547483 14 Dec 2025, 2:03:49 UTC 14 Dec 2025, 21:12:57 UTC Completed and validated 46,984.99 46,984.99 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583325 31547472 14 Dec 2025, 1:37:08 UTC 14 Dec 2025, 7:42:47 UTC Error while computing 222.84 0.73 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583322 31547469 14 Dec 2025, 1:29:46 UTC 14 Dec 2025, 7:42:47 UTC Error while computing 407.13 1.40 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583319 31547467 14 Dec 2025, 1:23:05 UTC 14 Dec 2025, 8:07:47 UTC Completed and validated 19,011.40 19,011.40 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580322 31545171 11 Dec 2025, 14:27:24 UTC 14 Dec 2025, 0:55:27 UTC Error while computing 34.33 1.04 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580318 31545168 11 Dec 2025, 14:27:07 UTC 14 Dec 2025, 0:55:27 UTC Error while computing 33.35 1.05 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580315 31545165 11 Dec 2025, 14:26:51 UTC 14 Dec 2025, 0:55:27 UTC Error while computing 34.42 1.07 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580259 31545130 11 Dec 2025, 14:23:51 UTC 14 Dec 2025, 1:05:14 UTC Completed and validated 174,956.81 87,720.81 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580250 31545085 11 Dec 2025, 14:22:50 UTC 11 Dec 2025, 14:25:48 UTC Error while computing 45.30 10.37 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580212 31545016 11 Dec 2025, 14:12:04 UTC 11 Dec 2025, 14:24:49 UTC Error while computing 42.10 1.67 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580204 31545050 11 Dec 2025, 14:10:49 UTC 11 Dec 2025, 14:24:49 UTC Error while computing 40.31 2.28 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580197 31545052 11 Dec 2025, 14:09:02 UTC 11 Dec 2025, 14:23:51 UTC Error while computing 41.81 1.29 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580190 31545025 11 Dec 2025, 14:08:04 UTC 11 Dec 2025, 14:22:50 UTC Error while computing 42.41 1.67 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580165 31545101 11 Dec 2025, 14:02:46 UTC 11 Dec 2025, 14:05:47 UTC Error while computing 43.34 1.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu

Next 20
State: All (36) · In progress (4) · Validation pending (0) · Validation inconclusive (0) · Valid (6) · Invalid (0) · Error (26)
Application: All (36) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (36) · 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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