All tasks for computer 621860



State: All (8) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (4) · Invalid (0) · Error (4)
Application: All (8) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · 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 (1)
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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
38584095 31545125 16 Dec 2025, 13:36:49 UTC 16 Dec 2025, 13:41:59 UTC Error while computing 55.34 9.46 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583481 31547607 14 Dec 2025, 6:31:41 UTC 14 Dec 2025, 10:56:45 UTC Aborted 15,462.46 7,535.63 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582829 31547072 13 Dec 2025, 12:40:26 UTC 13 Dec 2025, 17:46:58 UTC Completed and validated 14,453.08 14,453.08 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582688 31545797 13 Dec 2025, 9:40:21 UTC 13 Dec 2025, 13:42:29 UTC Completed and validated 14,528.00 14,868.56 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582389 31546709 13 Dec 2025, 3:27:47 UTC 13 Dec 2025, 5:18:56 UTC Completed and validated 6,669.00 6,826.13 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580942 31545156 12 Dec 2025, 7:26:01 UTC 13 Dec 2025, 14:18:08 UTC Aborted 1,554.18 697.23 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580876 31545468 12 Dec 2025, 3:41:16 UTC 12 Dec 2025, 6:52:07 UTC Completed and validated 11,451.00 11,541.27 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
33798736 27677965 2 Feb 2024, 7:46:21 UTC 2 Feb 2024, 8:14:09 UTC Error while computing 730.05 707.23 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu


State: All (8) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (4) · Invalid (0) · Error (4)
Application: All (8) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · 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 (1)
Task name:



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