All tasks for computer 637595



State: All (18) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (17)
Application: All (18) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (18) · 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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Show names		Work unit
click for details		SentTime reported
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38580429 31545254 11 Dec 2025, 14:34:21 UTC 12 Dec 2025, 9:30:18 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580425 31545250 11 Dec 2025, 14:34:04 UTC 12 Dec 2025, 9:30:18 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580403 31545233 11 Dec 2025, 14:32:35 UTC 12 Dec 2025, 9:30:18 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580398 31545229 11 Dec 2025, 14:32:18 UTC 12 Dec 2025, 9:32:02 UTC Aborted 68,262.60 23,652.99 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580399 31545077 11 Dec 2025, 14:32:18 UTC 12 Dec 2025, 9:30:18 UTC Aborted 0.00 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580395 31545227 11 Dec 2025, 14:32:05 UTC 12 Dec 2025, 9:32:02 UTC Aborted 68,318.64 24,425.41 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580305 31545117 11 Dec 2025, 14:26:04 UTC 11 Dec 2025, 14:28:07 UTC Error while computing 47.61 6.19 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580236 31545033 11 Dec 2025, 14:18:19 UTC 11 Dec 2025, 14:20:03 UTC Error while computing 50.59 5.70 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580211 31545054 11 Dec 2025, 14:12:03 UTC 11 Dec 2025, 14:14:06 UTC Error while computing 47.47 6.65 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580053 31545119 11 Dec 2025, 13:44:48 UTC 11 Dec 2025, 13:46:06 UTC Error while computing 47.02 5.86 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38580050 31545110 11 Dec 2025, 13:44:23 UTC 11 Dec 2025, 13:46:06 UTC Error while computing 50.85 16.01 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579890 31545103 11 Dec 2025, 13:26:19 UTC 11 Dec 2025, 13:28:06 UTC Error while computing 52.69 15.32 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579891 31545123 11 Dec 2025, 13:26:19 UTC 11 Dec 2025, 13:29:41 UTC Error while computing 49.81 15.92 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579733 31545064 11 Dec 2025, 13:18:06 UTC 11 Dec 2025, 13:20:06 UTC Error while computing 48.87 16.17 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579734 31545010 11 Dec 2025, 13:18:06 UTC 11 Dec 2025, 13:20:06 UTC Error while computing 46.48 6.68 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579697 31545043 11 Dec 2025, 13:16:03 UTC 11 Dec 2025, 13:18:06 UTC Error while computing 47.38 5.30 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579650 31545004 11 Dec 2025, 13:12:22 UTC 11 Dec 2025, 13:16:03 UTC Error while computing 47.91 15.46 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38579583 31544935 10 Dec 2025, 12:16:03 UTC 10 Dec 2025, 12:30:23 UTC Completed and validated 860.00 865.58 1,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (18) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (1) · Invalid (0) · Error (17)
Application: All (18) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (18) · 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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