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This may be difficult to implement if a docking program does not support rescoring natively. Also, rescoring may be completely rigid or a ligand may have translational and rotational degrees of freedom, while all dihedral angles are frozen.
This may be difficult to implement if a docking program does not support rescoring natively. Also, rescoring may be completely rigid or a ligand may have translational and rotational degrees of freedom, while all dihedral angles are frozen.