All tasks for computer 648018



State: All (7) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (6) · Invalid (0) · Error (0)
Application: All (7) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · 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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Show names		Work unit
click for details		SentTime reported
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38584213 31545193 16 Dec 2025, 16:06:10 UTC 21 Dec 2025, 16:06:10 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582486 31546794 13 Dec 2025, 5:57:41 UTC 13 Dec 2025, 9:33:38 UTC Completed and validated 12,957.00 13,177.65 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582338 31546663 13 Dec 2025, 2:11:49 UTC 13 Dec 2025, 5:57:23 UTC Completed and validated 13,534.00 13,842.91 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582169 31546525 12 Dec 2025, 22:36:14 UTC 13 Dec 2025, 2:11:49 UTC Completed and validated 12,935.00 13,130.49 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581392 31545916 12 Dec 2025, 10:46:51 UTC 12 Dec 2025, 15:00:03 UTC Completed and validated 15,192.00 15,258.44 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581393 31545917 12 Dec 2025, 10:46:51 UTC 12 Dec 2025, 22:35:57 UTC Completed and validated 13,508.23 13,508.23 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581394 31545918 12 Dec 2025, 10:46:51 UTC 12 Dec 2025, 18:58:01 UTC Completed and validated 14,845.34 14,845.34 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (7) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (6) · Invalid (0) · Error (0)
Application: All (7) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (7) · 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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