All tasks for computer 602125


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Application: All (22) · 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 (22)
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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
33800955 27678382 2 Feb 2024, 12:24:12 UTC 2 Feb 2024, 12:46:48 UTC Error while computing 1,030.14 1,005.32 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800945 27678459 2 Feb 2024, 12:19:59 UTC 2 Feb 2024, 12:23:34 UTC Error while computing 102.39 59.86 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800856 27678316 2 Feb 2024, 12:09:28 UTC 2 Feb 2024, 12:19:59 UTC Error while computing 523.60 490.99 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800829 27678441 2 Feb 2024, 12:06:54 UTC 2 Feb 2024, 12:09:28 UTC Error while computing 73.53 30.07 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800741 27678456 2 Feb 2024, 12:04:00 UTC 2 Feb 2024, 12:06:54 UTC Error while computing 81.51 39.98 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800706 27678347 2 Feb 2024, 12:00:31 UTC 2 Feb 2024, 12:04:00 UTC Error while computing 86.45 49.91 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788146 27678539 2 Feb 2024, 11:57:22 UTC 2 Feb 2024, 12:00:31 UTC Error while computing 103.31 59.33 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800575 27678474 2 Feb 2024, 11:54:39 UTC 2 Feb 2024, 11:57:22 UTC Error while computing 74.26 29.71 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800533 27678438 2 Feb 2024, 11:45:48 UTC 2 Feb 2024, 11:50:07 UTC Error while computing 145.71 109.50 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800627 27678344 2 Feb 2024, 11:45:10 UTC 2 Feb 2024, 11:54:38 UTC Error while computing 458.55 420.01 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800485 27678315 2 Feb 2024, 11:40:01 UTC 2 Feb 2024, 11:45:10 UTC Error while computing 128.41 89.55 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800525 27678461 2 Feb 2024, 11:39:24 UTC 2 Feb 2024, 11:45:10 UTC Error while computing 84.55 38.79 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800447 27678423 2 Feb 2024, 11:33:14 UTC 2 Feb 2024, 11:39:24 UTC Error while computing 91.47 50.09 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800297 27678428 2 Feb 2024, 11:21:58 UTC 2 Feb 2024, 11:25:45 UTC Error while computing 148.81 109.54 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800326 27678457 2 Feb 2024, 11:21:21 UTC 2 Feb 2024, 11:23:57 UTC Error while computing 80.83 40.03 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800225 27678318 2 Feb 2024, 11:14:39 UTC 2 Feb 2024, 11:21:21 UTC Error while computing 147.33 109.34 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788037 27678444 2 Feb 2024, 11:07:35 UTC 2 Feb 2024, 11:14:02 UTC Error while computing 114.81 69.76 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788022 27678431 2 Feb 2024, 11:01:53 UTC 2 Feb 2024, 11:07:35 UTC Error while computing 74.07 29.61 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788012 27678424 2 Feb 2024, 10:54:43 UTC 2 Feb 2024, 11:01:53 UTC Error while computing 84.37 39.77 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33799909 27678341 2 Feb 2024, 10:36:10 UTC 2 Feb 2024, 10:54:43 UTC Error while computing 116.04 69.65 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu

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State: All (22) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (0) · Invalid (0) · Error (22)
Application: All (22) · 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 (22)
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