All tasks for computer 630638



State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (4) · Invalid (0) · Error (1)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (5) · 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)
Task name:

Task
click for details
Show names		Work unit
click for details		SentTime reported
or deadline
explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38583047 31547251 13 Dec 2025, 18:01:39 UTC 14 Dec 2025, 3:17:49 UTC Completed and validated 13,985.82 13,985.82 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582915 31547144 13 Dec 2025, 14:46:40 UTC 13 Dec 2025, 18:25:37 UTC Completed and validated 13,137.00 13,927.90 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582566 31546863 13 Dec 2025, 7:26:40 UTC 13 Dec 2025, 11:11:41 UTC Completed and validated 13,501.00 14,447.23 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582547 31545878 13 Dec 2025, 7:06:38 UTC 13 Dec 2025, 7:14:11 UTC Error while computing 37.18 0.45 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582122 31546485 12 Dec 2025, 21:26:36 UTC 13 Dec 2025, 6:05:05 UTC Completed and validated 31,109.00 32,121.62 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (5) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (4) · Invalid (0) · Error (1)
Application: All (5) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (5) · 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)
Task name:



©2025 Universitat Pompeu Fabra