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  • src/molecule.hpp

    r477bb2 r6a7f78c  
    106106
    107107  // re-definition of virtual functions from PointCloud
     108  const char * const GetName() const;
    108109  Vector *GetCenter() const ;
    109110  TesselPoint *GetPoint() const ;
     
    296297  bool OutputTemperatureFromTrajectories(ofstream * const output, int startstep, int endstep);
    297298
    298   // Manipulation routines
    299   void flipActiveFlag();
    300 
    301299  private:
    302300  int last_atom;      //!< number given to last atom
     
    327325  int CountAllAtoms() const;
    328326
    329   // Methods moved here from the menus
    330   // TODO: more refactoring needed on these methods
    331   void flipChosen();
    332   void createNewMolecule(periodentafel *periode);
    333   void loadFromXYZ(periodentafel *periode);
    334   void changeName();
    335   void setMoleculeFilename();
    336   void parseXYZIntoMolecule();
    337   void eraseMolecule();
    338 
    339 
    340327  // merging of molecules
    341328  bool SimpleMerge(molecule *mol, molecule *srcmol);
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