All tasks for computer 650752



State: All (5) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (2) · Invalid (0) · Error (2)
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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38604043 31558221 11 Apr 2026, 10:31:09 UTC 16 Apr 2026, 10:31:09 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38601483 31556031 9 Apr 2026, 14:07:13 UTC 9 Apr 2026, 14:10:23 UTC Error while computing 63.56 0.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38601320 31555914 9 Apr 2026, 12:36:20 UTC 9 Apr 2026, 12:40:11 UTC Error while computing 69.71 0.58 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38599020 31554022 8 Apr 2026, 14:09:01 UTC 9 Apr 2026, 12:36:04 UTC Completed and validated 21,965.66 19,902.14 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64
38596576 31552528 8 Apr 2026, 7:28:52 UTC 8 Apr 2026, 13:59:12 UTC Completed and validated 23,203.21 18,802.31 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
windows_x86_64


State: All (5) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (2) · Invalid (0) · Error (2)
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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