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OpenBabel2Wrapper Class Reference

#include <openbabel2wrapper.h>

List of all members.


Detailed Description

Author:
Carsten Niehaus

Definition at line 29 of file openbabel2wrapper.h.


Static Public Member Functions

static Avogadro::Molecule * readMolecule (const QString &filename)
static QString getFormula (Avogadro::Molecule *molecule)
static QString getPrettyFormula (Avogadro::Molecule *molecule)

Member Function Documentation

Avogadro::Molecule * OpenBabel2Wrapper::readMolecule ( const QString &  filename  )  [static]

This class reads the molecule in the file filename.

It returns 0 if the file couldn't be read.

Definition at line 32 of file openbabel2wrapper.cpp.

QString OpenBabel2Wrapper::getFormula ( Avogadro::Molecule *  molecule  )  [static]

Definition at line 59 of file openbabel2wrapper.cpp.

QString OpenBabel2Wrapper::getPrettyFormula ( Avogadro::Molecule *  molecule  )  [static]

Definition at line 65 of file openbabel2wrapper.cpp.


The documentation for this class was generated from the following files:
  • openbabel2wrapper.h
  • openbabel2wrapper.cpp

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