All tasks for computer 601014



State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (4)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (4) · 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 (1)
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(sec)		CPU time
(sec)		CreditApplication
38644923 31589681 10 May 2026, 16:00:29 UTC 10 May 2026, 18:12:04 UTC Error while computing 7,895.00 7,897.62 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644897 31586492 10 May 2026, 10:24:28 UTC 10 May 2026, 17:10:39 UTC Completed and validated 23,874.66 23,874.66 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644505 31589731 8 May 2026, 19:54:24 UTC 8 May 2026, 20:18:03 UTC Error while computing 194.66 158.86 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38644441 31589668 8 May 2026, 16:38:30 UTC 8 May 2026, 16:54:07 UTC Error while computing 377.16 336.63 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
33794963 27676588 1 Feb 2024, 22:10:37 UTC 1 Feb 2024, 23:16:04 UTC Error while computing 3,854.56 3,848.35 --- 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 (1) · Invalid (0) · Error (4)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (4) · 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 (1)
Task name:



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