All tasks for computer 596452



State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (0) · Invalid (0) · Error (5)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (0) · 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 (5)
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Show names		Work unit
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
33800770 27678415 2 Feb 2024, 12:07:40 UTC 2 Feb 2024, 12:36:13 UTC Error while computing 1,585.54 1,546.79 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788157 27678549 2 Feb 2024, 12:00:30 UTC 2 Feb 2024, 12:07:40 UTC Error while computing 323.14 287.60 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800658 27678441 2 Feb 2024, 11:54:51 UTC 2 Feb 2024, 12:00:30 UTC Error while computing 229.97 187.83 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33787964 27678386 2 Feb 2024, 10:36:31 UTC 2 Feb 2024, 11:54:51 UTC Error while computing 4,605.84 4,590.88 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33787949 27678374 2 Feb 2024, 10:30:08 UTC 2 Feb 2024, 10:36:31 UTC Error while computing 288.94 249.32 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu


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



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