All tasks for computer 628831



State: All (4) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (2) · Error (1)
Application: All (4) · 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 (0)
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38584373 31545879 17 Dec 2025, 11:44:52 UTC 17 Dec 2025, 12:05:16 UTC Error while computing 278.70 3.02 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581511 31546031 12 Dec 2025, 10:50:46 UTC 12 Dec 2025, 23:39:43 UTC Completed and validated 23,078.59 20,641.16 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581512 31546032 12 Dec 2025, 10:50:46 UTC 17 Dec 2025, 18:00:39 UTC Completed, too late to validate 21,555.36 20,662.36 0.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38581499 31546020 12 Dec 2025, 10:50:46 UTC 17 Dec 2025, 18:00:39 UTC Completed, too late to validate 24,348.37 22,413.61 0.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


State: All (4) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (2) · Error (1)
Application: All (4) · 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 (0)
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