calpolyccg/MDSAPT

Identifying residues within a distance of specified residues

Opened this issue · 1 comments

ifd3f commented

Be able to identify all the residues within a cutoff distance of a specified residue, and then do the pairwise analysis with each of them. Or if the choose multiple residues feature was in place, all of them.

I'll create a notebook and try to implement this with the selection terminology