phmodel.cpp File Reference

Read pH rules and assign charges. More...

#include <openbabel/babelconfig.h>
#include <openbabel/mol.h>
#include <openbabel/phmodel.h>
#include "phmodeldata.h"

Include dependency graph for phmodel.cpp:


Namespaces

namespace  OpenBabel

Variables

OBPhModel phmodel
OBAtomTyper atomtyper

Detailed Description

Read pH rules and assign charges.