All tasks for computer 573351



State: All (16) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (0) · Invalid (0) · Error (16)
Application: All (16) · 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
33800862 27678352 2 Feb 2024, 12:10:05 UTC 2 Feb 2024, 12:35:47 UTC Error while computing 165.41 112.18 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800577 27678281 2 Feb 2024, 11:47:06 UTC 2 Feb 2024, 12:32:07 UTC Error while computing 1,369.69 1,344.03 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800478 27678469 2 Feb 2024, 11:34:04 UTC 2 Feb 2024, 11:47:06 UTC Error while computing 614.90 569.85 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800484 27678377 2 Feb 2024, 11:31:25 UTC 2 Feb 2024, 11:36:33 UTC Error while computing 172.95 119.32 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800415 27678424 2 Feb 2024, 11:29:11 UTC 2 Feb 2024, 11:34:03 UTC Error while computing 156.02 99.72 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800298 27678425 2 Feb 2024, 11:22:14 UTC 2 Feb 2024, 11:29:11 UTC Error while computing 175.06 116.50 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788076 27678476 2 Feb 2024, 11:18:42 UTC 2 Feb 2024, 11:26:20 UTC Error while computing 219.77 160.07 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788064 27678467 2 Feb 2024, 11:10:07 UTC 2 Feb 2024, 11:18:04 UTC Error while computing 184.45 128.54 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800086 27678370 2 Feb 2024, 11:05:29 UTC 2 Feb 2024, 11:18:04 UTC Error while computing 189.20 137.82 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788023 27678432 2 Feb 2024, 10:58:13 UTC 2 Feb 2024, 11:02:07 UTC Error while computing 129.77 77.31 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33799974 27678365 2 Feb 2024, 10:50:07 UTC 2 Feb 2024, 10:58:13 UTC Error while computing 132.87 77.00 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33799368 27678122 2 Feb 2024, 9:18:04 UTC 2 Feb 2024, 9:26:13 UTC Error while computing 309.93 248.87 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33787737 27678210 2 Feb 2024, 8:58:27 UTC 2 Feb 2024, 9:13:32 UTC Error while computing 740.87 699.35 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33794593 27676520 1 Feb 2024, 21:18:06 UTC 1 Feb 2024, 21:36:37 UTC Error while computing 920.82 884.08 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
32883875 27217568 14 Apr 2022, 11:02:40 UTC 14 Apr 2022, 11:37:27 UTC Error while computing 1,637.23 1,637.23 --- ACEMD 4: molecular dynamics simulations for GPUs v1.03 (cuda1121)
x86_64-pc-linux-gnu
32883876 27217569 14 Apr 2022, 11:02:40 UTC 14 Apr 2022, 12:03:04 UTC Error while computing 1,634.41 1,634.41 --- ACEMD 4: molecular dynamics simulations for GPUs v1.03 (cuda1121)
x86_64-pc-linux-gnu


State: All (16) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (0) · Invalid (0) · Error (16)
Application: All (16) · 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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