DockFlow asks to "rewrite original ligands", if we say NO and the molecules aren't @LigFlow folder, if behaves weirdly.
Everytime we run, it should verify if each ligand is there already, or else just write it there.
If it finds the ligand there, ask to rewrite a specific ligand or --rewrite-all.
DockFlow asks to "rewrite original ligands", if we say NO and the molecules aren't @LigFlow folder, if behaves weirdly.
Everytime we run, it should verify if each ligand is there already, or else just write it there. If it finds the ligand there, ask to rewrite a specific ligand or --rewrite-all.