# | Line 57 | Line 57 | bool OBGastChrg::AssignPartialCharges(OBMol &mol) | |
---|---|---|
57 | bool OBGastChrg::AssignPartialCharges(OBMol &mol) | |
58 | { | |
59 | //InitialPartialCharges(mol); | |
60 | < | obErrorLog.ThrowError(__FUNCTION__, |
60 | > | obErrorLog.ThrowError(__func__, |
61 | "Ran OpenBabel::AssignPartialCharges", obAuditMsg); | |
62 | ||
63 | OBAtom *atom; |
– | Removed lines |
+ | Added lines |
< | Changed lines |
> | Changed lines |