All tasks for computer 615363



State: All (5) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · 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)
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38585124 31548554 18 Dec 2025, 22:47:30 UTC 23 Dec 2025, 22:47:30 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38585002 31548463 18 Dec 2025, 12:20:03 UTC 18 Dec 2025, 21:55:19 UTC Completed and validated 34,516.00 34,557.23 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38584378 31545215 17 Dec 2025, 12:40:57 UTC 17 Dec 2025, 16:52:15 UTC Cancelled by server 15,048.47 5,534.15 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38583934 31547922 14 Dec 2025, 23:34:41 UTC 17 Dec 2025, 19:50:11 UTC Completed and validated 58,988.53 58,988.53 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38582987 31547201 13 Dec 2025, 16:32:44 UTC 14 Dec 2025, 8:35:56 UTC Completed and validated 57,792.00 57,855.48 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (5) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (3) · 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)
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