All tasks for computer 635639



State: All (13) · In progress (5) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (7)
Application: All (13) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (13) · 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)
Task name:

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Show names		Work unit
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(sec)		CPU time
(sec)		CreditApplication
38583997 31545985 15 Dec 2025, 5:42:21 UTC 20 Dec 2025, 5:42:21 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583998 31545989 15 Dec 2025, 5:42:21 UTC 20 Dec 2025, 5:42:21 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583999 31546009 15 Dec 2025, 5:42:21 UTC 20 Dec 2025, 5:42:21 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583988 31545877 15 Dec 2025, 4:05:36 UTC 15 Dec 2025, 4:07:35 UTC Error while computing 49.52 0.81 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583987 31545827 15 Dec 2025, 3:22:50 UTC 15 Dec 2025, 3:27:24 UTC Error while computing 47.57 0.85 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583945 31545050 14 Dec 2025, 23:55:01 UTC 15 Dec 2025, 0:55:50 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583935 31545062 14 Dec 2025, 23:34:46 UTC 15 Dec 2025, 0:55:50 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583918 31547912 14 Dec 2025, 22:54:59 UTC 19 Dec 2025, 22:54:59 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583905 31545131 14 Dec 2025, 22:21:14 UTC 14 Dec 2025, 23:29:31 UTC Aborted 3,757.02 2,277.93 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583902 31547893 14 Dec 2025, 22:16:48 UTC 19 Dec 2025, 22:16:48 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583603 31547693 14 Dec 2025, 9:59:05 UTC 14 Dec 2025, 14:49:29 UTC Completed and validated 16,655.73 16,655.73 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582850 31545878 13 Dec 2025, 13:06:57 UTC 13 Dec 2025, 13:57:08 UTC Error while computing 59.45 2.42 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580691 31544998 11 Dec 2025, 16:35:03 UTC 11 Dec 2025, 16:57:49 UTC Error while computing 102.56 35.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (13) · In progress (5) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (7)
Application: All (13) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (13) · 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)
Task name:



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