10 #ifndef _RD_GASTEIGERCHARGES_H 11 #define _RD_GASTEIGERCHARGES_H 18 bool throwOnParamFailure=
false);
20 bool throwOnParamFailure=
false);
22 int nIter=12,
bool throwOnParamFailure=
false);
void computeGasteigerCharges(const ROMol *mol, int nIter=12, bool throwOnParamFailure=false)
Includes a bunch of functionality for handling Atom and Bond queries.