Improve grouping with selection

Question

Improve grouping with selection

demianriccardi opened this issue 7 years ago · 2 comments

creating grouping of unique cysteine residues required too much Perl. The trouble for those with same resid, but different chains; group_by_atom_attr would need another attr. Perhaps group_by_atom_attrs with an internal union would work.

demianriccardi commented 7 years ago

e4cad40

Answer 1 · 2017-06-19T15:15:57.000Z

group_by_atom_attrs needs to be tested out for use and edge cases (empty, non-existent attrs)