All tasks for computer 611696



State: All (16) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (9) · Invalid (0) · Error (7)
Application: All (16) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (14) · 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 (2)
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38676833 31618729 26 Oct 2026, 12:29:25 UTC 26 Oct 2026, 12:53:28 UTC Completed and validated 1,407.84 1,350.09 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38648463 31593164 24 Oct 2026, 1:36:08 UTC 24 Oct 2026, 4:22:33 UTC Completed and validated 2,151.61 1,098.21 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38650462 31594963 24 Oct 2026, 0:05:02 UTC 24 Oct 2026, 3:45:55 UTC Completed and validated 1,468.83 1,408.62 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38649805 31594381 23 Oct 2026, 23:40:39 UTC 24 Oct 2026, 3:21:22 UTC Completed and validated 4,477.95 1,242.80 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38650189 31594707 23 Oct 2026, 23:18:32 UTC 24 Oct 2026, 2:06:59 UTC Error while computing 120.19 23.00 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38650191 31594709 23 Oct 2026, 23:18:32 UTC 24 Oct 2026, 1:29:41 UTC Completed and validated 1,292.31 1,235.35 60,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38645550 31590514 23 Oct 2026, 16:08:38 UTC 24 Oct 2026, 0:05:01 UTC Completed and validated 1,901.08 1,236.07 1,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38645562 31590526 23 Oct 2026, 16:08:38 UTC 23 Oct 2026, 22:25:25 UTC Completed and validated 1,235.61 1,153.03 1,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38645427 31590391 23 Oct 2026, 16:08:38 UTC 23 Oct 2026, 23:09:29 UTC Completed and validated 2,526.46 1,076.51 1,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38645439 31590403 23 Oct 2026, 16:08:38 UTC 23 Oct 2026, 23:31:47 UTC Completed and validated 1,331.38 1,251.30 1,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38596096 31552186 24 Mar 2026, 11:02:48 UTC 27 Mar 2026, 2:31:06 UTC Error while computing 63.82 29.39 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38596091 31552183 24 Mar 2026, 11:02:48 UTC 27 Mar 2026, 2:31:06 UTC Error while computing 65.84 30.39 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38596092 31552184 24 Mar 2026, 11:02:48 UTC 27 Mar 2026, 2:31:06 UTC Error while computing 74.02 32.20 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38596093 31552134 24 Mar 2026, 11:02:48 UTC 27 Mar 2026, 2:31:06 UTC Error while computing 58.02 19.07 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
33798840 27678066 2 Feb 2024, 8:07:17 UTC 2 Feb 2024, 8:17:49 UTC Error while computing 521.45 492.30 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu
33796165 27676951 2 Feb 2024, 0:49:26 UTC 2 Feb 2024, 0:55:28 UTC Error while computing 258.89 230.51 --- Quantum chemistry calculations on GPU v1.04 (cuda1121)
x86_64-pc-linux-gnu


State: All (16) · In progress (0) · Validation pending (0) · Validation inconclusive (0) · Valid (9) · Invalid (0) · Error (7)
Application: All (16) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (14) · 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 (2)
Task name:



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