OpenBabelConverter.h
406 Bytes
#ifndef CONVERTS2G_H_
#define CONVERTS2G_H_
#include "Utility.h"
#include "BaseGraphClass.h"
#include "GraphClass.h"
#include <openbabel/mol.h>
#include <openbabel/obconversion.h>
using namespace std;
class OpenBabelConverter
{
OpenBabel::OBConversion obconversion;
public:
void ConvertOpenBabelFormatToGraph(istream* pIn, GraphClass& oG, string aFormat);
~OpenBabelConverter() {};
};
#endif