Greg Landrum 6664dd7fe4 Some modernization of core GraphMol classes (#7228) ...

* simple modernization

* more

* done with RWMol for this pass

* the ROMol.cpp variant

* Atom

* minor change to bond

* simplify Conformer

* monomerinfo, queryatom, querybond

queryatom and querybond cpp files still need to be done

* typos

* revert a dumb change

* suggestion from review

2024-03-17 06:04:04 +01:00

4.3 KiB

Raw Permalink Blame History

View Raw