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Category: Completed Research Forum: Smash Childhood Cancer Thread: [Error] No atoms in the ligand |
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Thread Status: Active Total posts in this thread: 2
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adriverhoef
Master Cruncher The Netherlands Joined: Apr 3, 2009 Post Count: 2104 Status: Offline Project Badges: |
Saw this error popping up, just like in post 547966 (from 2017) and post 608154 (from 2019):
----------------------------------------workunit 380115144 SCC1_0004356_KLF15-A_38697_0 MSWin 10 Error 2023-09-18T04:31:52 2023-09-19T21:27:34 0.00/0.00Details: --------------------------------------------------------------------------------------------------------------------------------------- SCC1_0004356_KLF15-A_38697_0 MSWin 10 Error 2023-09-18T04:31:52 2023-09-19T21:27:34 0.00/0.00 Out of 10,000 completed SCC1-tasks available in my Results, this was the only one with the error. Inspection of 20 surrounding workunits (380115134 to 380115154) also didn't reveal any errors. According to Seippel in post 417882: The pdbqt line in the output give information about two pdbqt files being docked. The first is the ligand being docked and the second is the receptor site (which is why it's larger). The two numbers after each give information about the number of atoms and branches for each. Adri [Edit 1 times, last edit by adriverhoef at Sep 20, 2023 9:27:13 AM] |
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TigerLily
Senior Cruncher Joined: May 26, 2023 Post Count: 280 Status: Offline Project Badges: |
Hi Adri,
Thanks for sharing this. I forwarded this to the tech team. |
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