All tasks for computer 648006



State: All (20) · In progress (4) · Validation pending (0) · Validation inconclusive (0) · Valid (12) · Invalid (0) · Error (4)
Application: All (20) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (20) · 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
click for details		SentTime reported
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38583914 31547909 14 Dec 2025, 22:47:40 UTC 19 Dec 2025, 22:47:40 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583703 31547770 14 Dec 2025, 13:47:21 UTC 19 Dec 2025, 13:47:21 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583522 31547472 14 Dec 2025, 7:42:55 UTC 19 Dec 2025, 7:42:55 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583452 31547585 14 Dec 2025, 5:38:37 UTC 19 Dec 2025, 5:38:37 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583287 31547445 14 Dec 2025, 0:33:34 UTC 14 Dec 2025, 19:49:38 UTC Completed and validated 22,645.30 22,645.30 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583193 31547365 13 Dec 2025, 22:00:24 UTC 14 Dec 2025, 13:42:15 UTC Completed and validated 22,794.80 22,794.80 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583100 31547295 13 Dec 2025, 19:15:34 UTC 14 Dec 2025, 7:28:34 UTC Completed and validated 8,908.26 8,877.06 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583037 31547243 13 Dec 2025, 17:52:53 UTC 14 Dec 2025, 5:03:41 UTC Completed and validated 17,814.24 17,814.24 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582735 31547000 13 Dec 2025, 10:45:27 UTC 14 Dec 2025, 0:10:54 UTC Completed and validated 9,142.65 9,131.33 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582666 31546943 13 Dec 2025, 9:19:15 UTC 13 Dec 2025, 21:38:28 UTC Completed and validated 9,059.99 9,019.25 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582614 31546409 13 Dec 2025, 8:17:52 UTC 13 Dec 2025, 19:07:22 UTC Completed and validated 8,761.46 8,709.32 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582401 31546720 13 Dec 2025, 3:51:24 UTC 13 Dec 2025, 16:41:50 UTC Aborted 22,665.70 22,665.70 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582197 31545092 12 Dec 2025, 23:09:56 UTC 13 Dec 2025, 8:50:46 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581692 31546054 12 Dec 2025, 13:11:55 UTC 13 Dec 2025, 10:37:26 UTC Completed and validated 8,962.76 8,902.58 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580983 31545513 12 Dec 2025, 9:54:29 UTC 13 Dec 2025, 8:11:35 UTC Completed and validated 17,896.53 17,896.53 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580978 31545511 12 Dec 2025, 9:35:18 UTC 13 Dec 2025, 3:21:42 UTC Completed and validated 17,799.05 17,799.05 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580964 31545162 12 Dec 2025, 9:08:14 UTC 12 Dec 2025, 22:29:21 UTC Aborted 33,977.06 15,324.66 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580941 31545079 12 Dec 2025, 7:26:00 UTC 12 Dec 2025, 8:12:25 UTC Error while computing 99.55 30.41 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580908 31545486 12 Dec 2025, 5:20:17 UTC 12 Dec 2025, 13:06:24 UTC Completed and validated 17,834.16 17,834.16 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580523 31545265 11 Dec 2025, 16:04:00 UTC 11 Dec 2025, 23:50:28 UTC Completed and validated 18,617.30 18,617.30 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (20) · In progress (4) · Validation pending (0) · Validation inconclusive (0) · Valid (12) · Invalid (0) · Error (4)
Application: All (20) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (20) · 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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