typer.cpp File Reference

#include <openbabel/babelconfig.h>
#include <openbabel/mol.h>
#include <openbabel/atom.h>
#include <openbabel/bond.h>
#include <openbabel/ring.h>
#include <openbabel/obiter.h>
#include <openbabel/oberror.h>
#include <openbabel/typer.h>
#include <openbabel/elements.h>
#include "atomtyp.h"

Namespaces
	OpenBabel

Enumerations
enum	ExocyclicAtom { NO_EXOCYCLIC_ATOM, EXO_OXYGEN, EXO_NONOXYGEN }

Functions
static ExocyclicAtom	FindExocyclicAtom (OBAtom *atm)
static bool	HasExocyclicBondToOxygenMinus (OBAtom *atm)
static bool	HasExocyclicDblBondToOxygen (OBAtom *atm)
static bool	HasExocyclicDblBondToHet (OBAtom *atm)
static bool	AssignOBAromaticityModel (OBAtom *atm, int &min, int &max)

Detailed Description

Open Babel atom and aromaticity typer.