After the refactoring of flexibility.py (32f24695526d3bdc0fc213c5170bdcbd51691992) that currently lives in the residue_molsetups branch, all attributes of rings stored in the molsetup can be removed: corner_flip, graph, and is_aromatic. The only information that is needed are the indices of the atoms that constitute the ring, which have been used as key to the molsetup.rings dictionary.
After the refactoring of
flexibility.py
(32f24695526d3bdc0fc213c5170bdcbd51691992) that currently lives in theresidue_molsetups
branch, all attributes of rings stored in the molsetup can be removed:corner_flip
,graph
, andis_aromatic
. The only information that is needed are the indices of the atoms that constitute the ring, which have been used as key to themolsetup.rings
dictionary.