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smina
Resolved: uninstalled and reinstalled everything!
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get this error: 'Parse error on line 4 in file "1OYT-FSN.pdbqt": Unknown or inappropriate tag' with this command: smina -r 1OYT-receptor.pdbqt -l 1OYT-FSN.pdbqt --autobox_ligand 1OYT-FSN.pdbqt --autobox_add 8 --exhaustiveness 16 -o 1OYT-redock.pdbqt pdbqt files were generated from pdb files with openbabel 3.1.1 using: obabel 1OYT-receptor.pdb -xr -O 1OYT-receptor.pdbqt obabel 1OYT-FSN.pdb -xr -O 1OYT-FSN.pdbqt I'm new to command line work in general, and have a new macbook pro M1. After reading the...
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- tvargo
- Joined:
- 2022-05-12 15:09:31.999000
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