All tasks for computer 603301



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
33788215 27678597 2 Feb 2024, 12:24:50 UTC 2 Feb 2024, 12:31:41 UTC Error while computing 200.13 153.60 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788210 27678593 2 Feb 2024, 12:24:17 UTC 2 Feb 2024, 12:31:41 UTC Error while computing 197.93 159.31 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800803 27678405 2 Feb 2024, 12:17:56 UTC 2 Feb 2024, 12:24:16 UTC Error while computing 225.11 188.94 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788163 27678554 2 Feb 2024, 12:12:42 UTC 2 Feb 2024, 12:17:56 UTC Error while computing 241.33 208.96 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33788185 27678572 2 Feb 2024, 12:11:58 UTC 2 Feb 2024, 12:24:16 UTC Error while computing 533.93 496.31 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800757 27678376 2 Feb 2024, 12:05:43 UTC 2 Feb 2024, 12:11:58 UTC Error while computing 154.89 119.53 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800783 27678425 2 Feb 2024, 12:04:59 UTC 2 Feb 2024, 12:11:58 UTC Error while computing 177.20 139.40 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800732 27678393 2 Feb 2024, 11:59:06 UTC 2 Feb 2024, 12:04:59 UTC Error while computing 124.74 89.82 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33800107 27678329 2 Feb 2024, 11:00:04 UTC 2 Feb 2024, 11:49:21 UTC Error while computing 2,862.06 2,838.13 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33787907 27678340 2 Feb 2024, 10:20:13 UTC 2 Feb 2024, 10:23:48 UTC Error while computing 137.77 99.62 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33799051 27678066 2 Feb 2024, 8:38:20 UTC 2 Feb 2024, 9:00:32 UTC Error while computing 1,202.98 1,175.36 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33787658 27678146 2 Feb 2024, 8:24:32 UTC 2 Feb 2024, 8:31:35 UTC Error while computing 234.55 199.22 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33798560 27677938 2 Feb 2024, 7:43:43 UTC 2 Feb 2024, 8:13:40 UTC Error while computing 1,688.25 1,662.15 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33787131 27677707 2 Feb 2024, 5:06:46 UTC 2 Feb 2024, 5:40:31 UTC Error while computing 1,918.02 1,891.08 --- 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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