Closed primaryodors closed 11 months ago
Ensures heavy atoms will not be brought closer together than their combined vdW radii, unless they or their hydrogens share an interaction.
Also fixes a problem where like charges were registering as attractive instead of repulsive.
Ensures heavy atoms will not be brought closer together than their combined vdW radii, unless they or their hydrogens share an interaction.
Also fixes a problem where like charges were registering as attractive instead of repulsive.