All tasks for computer 600905



State: All (14) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (0) · Invalid (0) · Error (14)
Application: All (14) · 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 (14)
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Show names		Work unit
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
33801010 27678221 2 Feb 2024, 12:24:29 UTC 2 Feb 2024, 12:43:20 UTC Error while computing 1,060.16 876.49 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800920 27678370 2 Feb 2024, 12:18:59 UTC 2 Feb 2024, 12:24:29 UTC Error while computing 209.78 10.55 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800869 27678343 2 Feb 2024, 12:12:33 UTC 2 Feb 2024, 12:18:59 UTC Error while computing 277.81 82.46 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800774 27678451 2 Feb 2024, 12:06:26 UTC 2 Feb 2024, 12:12:33 UTC Error while computing 247.48 62.80 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800748 27678398 2 Feb 2024, 12:00:08 UTC 2 Feb 2024, 12:06:26 UTC Error while computing 252.19 63.06 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800646 27678453 2 Feb 2024, 11:53:46 UTC 2 Feb 2024, 12:00:08 UTC Error while computing 258.26 68.78 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800593 27678484 2 Feb 2024, 11:47:35 UTC 2 Feb 2024, 11:53:09 UTC Error while computing 251.24 62.36 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800550 27678412 2 Feb 2024, 11:38:43 UTC 2 Feb 2024, 11:47:35 UTC Error while computing 340.11 91.03 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788078 27678478 2 Feb 2024, 11:25:38 UTC 2 Feb 2024, 11:32:06 UTC Error while computing 263.76 70.94 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800315 27678338 2 Feb 2024, 11:20:00 UTC 2 Feb 2024, 11:25:38 UTC Error while computing 266.58 71.66 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788059 27678462 2 Feb 2024, 11:14:22 UTC 2 Feb 2024, 11:20:00 UTC Error while computing 258.17 62.50 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800138 27678341 2 Feb 2024, 11:07:58 UTC 2 Feb 2024, 11:14:22 UTC Error while computing 294.24 102.01 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33799979 27678348 2 Feb 2024, 10:41:12 UTC 2 Feb 2024, 10:46:09 UTC Error while computing 222.46 32.79 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33787797 27678252 2 Feb 2024, 9:29:06 UTC 2 Feb 2024, 10:02:23 UTC Error while computing 1,884.43 1,692.26 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu


State: All (14) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (0) · Invalid (0) · Error (14)
Application: All (14) · 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 (14)
Task name:



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