All tasks for computer 654948



State: All (20) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (13) · Invalid (0) · Error (7)
Application: All (20) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (20) · 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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38679183 31620974 26 Oct 2026, 19:44:05 UTC 26 Oct 2026, 19:54:05 UTC Error while computing 469.55 469.55 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38678237 31620067 26 Oct 2026, 16:48:39 UTC 26 Oct 2026, 16:53:38 UTC Error while computing 24.07 0.52 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38678238 31620068 26 Oct 2026, 16:48:39 UTC 26 Oct 2026, 16:53:38 UTC Error while computing 24.40 0.50 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677958 31619805 26 Oct 2026, 15:58:17 UTC 26 Oct 2026, 16:20:43 UTC Error while computing 31.37 8.08 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677955 31619764 26 Oct 2026, 15:58:01 UTC 26 Oct 2026, 16:16:30 UTC Completed and validated 594.93 594.93 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677956 31619765 26 Oct 2026, 15:58:01 UTC 26 Oct 2026, 16:07:42 UTC Error while computing 481.05 474.34 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677957 31619804 26 Oct 2026, 15:58:01 UTC 26 Oct 2026, 16:20:43 UTC Error while computing 26.49 0.44 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677855 31619709 26 Oct 2026, 15:37:44 UTC 26 Oct 2026, 15:58:01 UTC Completed and validated 609.45 601.18 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677800 31619656 26 Oct 2026, 15:26:58 UTC 26 Oct 2026, 15:47:56 UTC Completed and validated 606.57 600.52 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677801 31619657 26 Oct 2026, 15:26:58 UTC 26 Oct 2026, 15:37:44 UTC Completed and validated 601.13 594.32 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677679 31619541 26 Oct 2026, 15:03:50 UTC 26 Oct 2026, 15:14:24 UTC Completed and validated 595.10 589.34 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677375 31619249 26 Oct 2026, 14:10:15 UTC 26 Oct 2026, 14:32:11 UTC Error while computing 35.46 7.98 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677376 31619250 26 Oct 2026, 14:10:15 UTC 26 Oct 2026, 14:30:23 UTC Completed and validated 595.53 588.48 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677374 31619248 26 Oct 2026, 14:09:58 UTC 26 Oct 2026, 14:20:28 UTC Completed and validated 592.99 587.22 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38677328 31619203 26 Oct 2026, 13:59:24 UTC 26 Oct 2026, 14:09:58 UTC Completed and validated 596.07 590.00 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38676037 31617973 26 Oct 2026, 10:04:32 UTC 26 Oct 2026, 10:24:35 UTC Completed and validated 596.43 590.20 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38675924 31617870 26 Oct 2026, 9:44:04 UTC 26 Oct 2026, 10:14:29 UTC Completed and validated 596.40 587.64 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38675923 31617869 26 Oct 2026, 9:44:03 UTC 26 Oct 2026, 10:04:32 UTC Completed and validated 596.54 588.75 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38675925 31617871 26 Oct 2026, 9:44:03 UTC 26 Oct 2026, 9:54:33 UTC Completed and validated 595.18 588.90 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38675834 31617782 26 Oct 2026, 9:26:19 UTC 26 Oct 2026, 9:43:46 UTC Completed and validated 640.39 592.93 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (20) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (13) · Invalid (0) · Error (7)
Application: All (20) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (20) · 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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