All tasks for computer 651884



State: All (20) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (15) · Invalid (0) · Error (4)
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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38603337 31557621 10 Apr 2026, 16:39:53 UTC 15 Apr 2026, 16:39:53 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38603278 31557562 10 Apr 2026, 15:08:36 UTC 10 Apr 2026, 18:25:50 UTC Completed and validated 11,834.00 14,774.26 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38603064 31557380 10 Apr 2026, 11:38:45 UTC 10 Apr 2026, 15:08:19 UTC Completed and validated 12,574.00 15,057.00 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38603063 31557379 10 Apr 2026, 11:38:29 UTC 10 Apr 2026, 16:39:36 UTC Completed and validated 18,067.00 20,704.31 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602862 31557204 10 Apr 2026, 8:17:21 UTC 10 Apr 2026, 11:38:12 UTC Completed and validated 12,051.00 14,266.22 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602766 31557120 10 Apr 2026, 6:50:03 UTC 10 Apr 2026, 12:02:29 UTC Completed and validated 18,746.00 21,542.79 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602695 31557057 10 Apr 2026, 5:39:34 UTC 10 Apr 2026, 11:21:38 UTC Completed and validated 20,524.00 23,189.89 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602644 31556112 10 Apr 2026, 4:57:08 UTC 10 Apr 2026, 8:17:06 UTC Completed and validated 11,998.00 14,724.51 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602399 31556814 10 Apr 2026, 1:21:25 UTC 10 Apr 2026, 6:49:45 UTC Completed and validated 19,700.00 21,393.79 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602290 31556724 9 Apr 2026, 23:46:42 UTC 10 Apr 2026, 5:39:16 UTC Completed and validated 21,154.00 23,282.93 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602041 31556512 9 Apr 2026, 20:38:54 UTC 10 Apr 2026, 2:00:13 UTC Completed and validated 19,279.00 21,714.12 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601946 31556435 9 Apr 2026, 19:40:18 UTC 10 Apr 2026, 1:21:06 UTC Completed and validated 20,448.00 22,330.16 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601945 31556434 9 Apr 2026, 19:40:01 UTC 9 Apr 2026, 23:09:37 UTC Completed and validated 12,576.00 14,231.65 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601507 31556046 9 Apr 2026, 14:25:40 UTC 9 Apr 2026, 19:40:01 UTC Completed and validated 18,861.00 22,713.34 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601382 31555956 9 Apr 2026, 13:01:57 UTC 9 Apr 2026, 18:01:35 UTC Completed and validated 17,978.00 21,646.27 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601381 31553375 9 Apr 2026, 13:01:40 UTC 9 Apr 2026, 13:09:02 UTC Error while computing 46.75 0.32 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601310 31555543 9 Apr 2026, 12:32:40 UTC 9 Apr 2026, 12:42:19 UTC Error while computing 429.14 413.12 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601296 31555897 9 Apr 2026, 12:26:39 UTC 9 Apr 2026, 12:42:19 UTC Error while computing 428.02 412.30 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601280 31555883 9 Apr 2026, 12:20:33 UTC 9 Apr 2026, 12:42:19 UTC Error while computing 1,306.00 1,484.93 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601205 31555816 9 Apr 2026, 11:30:24 UTC 9 Apr 2026, 15:03:13 UTC Completed and validated 12,769.00 15,254.41 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (20) · In progress (1) · Validation pending (0) · Validation inconclusive (0) · Valid (15) · Invalid (0) · Error (4)
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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