All tasks for computer 650701



State: All (16) · In progress (3) · Validation pending (0) · Validation inconclusive (0) · Valid (11) · Invalid (0) · Error (2)
Application: All (16) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (16) · 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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Show names		Work unit
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explain		StatusRun time
(sec)		CPU time
(sec)		CreditApplication
38603364 31557638 10 Apr 2026, 17:08:55 UTC 15 Apr 2026, 17:08:55 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38603315 31557599 10 Apr 2026, 16:08:51 UTC 15 Apr 2026, 16:08:51 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38603154 31557025 10 Apr 2026, 13:06:37 UTC 15 Apr 2026, 13:06:37 UTC In progress --- --- --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602409 31556823 10 Apr 2026, 1:32:36 UTC 10 Apr 2026, 16:08:51 UTC Completed and validated 18,728.33 15,851.28 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38602410 31556824 10 Apr 2026, 1:32:36 UTC 10 Apr 2026, 19:53:57 UTC Completed and validated 13,479.11 10,354.04 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601895 31556393 9 Apr 2026, 19:02:40 UTC 10 Apr 2026, 10:55:43 UTC Completed and validated 24,394.78 22,562.02 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601403 31554305 9 Apr 2026, 13:15:50 UTC 9 Apr 2026, 22:49:11 UTC Completed and validated 20,756.77 18,208.32 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38601404 31555971 9 Apr 2026, 13:15:50 UTC 10 Apr 2026, 4:08:10 UTC Completed and validated 19,072.44 16,393.70 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38600792 31555458 9 Apr 2026, 7:17:42 UTC 9 Apr 2026, 17:02:18 UTC Completed and validated 13,086.78 10,430.77 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38600791 31555457 9 Apr 2026, 7:17:24 UTC 9 Apr 2026, 13:23:12 UTC Completed and validated 21,859.37 21,709.00 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38600463 31555183 9 Apr 2026, 3:46:49 UTC 9 Apr 2026, 7:17:24 UTC Error while computing 9,416.22 8,682.62 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38599724 31554581 8 Apr 2026, 20:32:07 UTC 9 Apr 2026, 4:39:16 UTC Error while computing 93.46 18.06 --- ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38599187 31554153 8 Apr 2026, 15:36:15 UTC 9 Apr 2026, 3:57:23 UTC Completed and validated 21,804.14 21,804.14 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38598413 31553490 8 Apr 2026, 9:46:59 UTC 8 Apr 2026, 21:58:26 UTC Completed and validated 16,283.48 16,283.48 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38596957 31552892 8 Apr 2026, 7:46:54 UTC 8 Apr 2026, 12:36:04 UTC Completed and validated 17,350.00 17,547.52 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu
38597008 31552926 8 Apr 2026, 7:46:54 UTC 8 Apr 2026, 17:31:59 UTC Completed and validated 18,019.65 18,019.65 750,000.00 ATM: Free energy calculations of protein-ligand binding v1.20 (cuda1121)
x86_64-pc-linux-gnu


State: All (16) · In progress (3) · Validation pending (0) · Validation inconclusive (0) · Valid (11) · Invalid (0) · Error (2)
Application: All (16) · ACEMD 3: molecular dynamics simulations for GPUs (0) · ATM: Free energy calculations of protein-ligand binding (16) · 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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