All tasks for computer 637038



State: All (12) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (10) · Invalid (0) · Error (2)
Application: All (12) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (12) · 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
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38581677 31546130 12 Dec 2025, 12:45:25 UTC 13 Dec 2025, 4:09:53 UTC Completed and validated 16,415.84 16,415.84 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581671 31546126 12 Dec 2025, 12:40:59 UTC 13 Dec 2025, 0:49:44 UTC Completed and validated 17,552.05 17,552.05 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581641 31545884 12 Dec 2025, 11:53:36 UTC 13 Dec 2025, 0:49:44 UTC Completed and validated 15,719.40 15,719.40 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581635 31545761 12 Dec 2025, 11:36:21 UTC 13 Dec 2025, 2:29:47 UTC Completed and validated 39,673.53 39,673.53 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581634 31545892 12 Dec 2025, 11:35:36 UTC 12 Dec 2025, 21:29:36 UTC Completed and validated 17,106.50 17,106.50 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581630 31545781 12 Dec 2025, 11:33:24 UTC 13 Dec 2025, 0:49:44 UTC Completed and validated 35,745.22 35,745.22 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581629 31546107 12 Dec 2025, 11:30:23 UTC 12 Dec 2025, 19:49:29 UTC Completed and validated 29,946.00 30,313.22 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581628 31545964 12 Dec 2025, 11:28:07 UTC 12 Dec 2025, 11:34:08 UTC Error while computing 36.79 0.55 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581320 31545845 12 Dec 2025, 10:47:44 UTC 12 Dec 2025, 16:29:18 UTC Completed and validated 17,275.20 17,275.20 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581346 31545871 12 Dec 2025, 10:47:44 UTC 12 Dec 2025, 16:29:18 UTC Completed and validated 17,323.80 17,323.80 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581347 31545872 12 Dec 2025, 10:47:44 UTC 12 Dec 2025, 16:29:18 UTC Completed and validated 15,817.66 15,817.66 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38581412 31545826 12 Dec 2025, 10:47:44 UTC 12 Dec 2025, 11:22:56 UTC Error while computing 38.08 0.54 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (12) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (10) · Invalid (0) · Error (2)
Application: All (12) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (12) · 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:



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