25 #ifndef __vtkOpenQubeMoleculeSource_h
26 #define __vtkOpenQubeMoleculeSource_h
66 virtual void SetBasisSet(OpenQube::BasisSet *
b);
95 void CopyOQMoleculeToVtkMolecule(
const OpenQube::Molecule *oqmol,
GLboolean GLboolean GLboolean b
class describing a molecule
#define vtkGetMacro(name, type)
virtual int RequestData(vtkInformation *, vtkInformationVector **, vtkInformationVector *)
#define vtkSetStringMacro(name)
#define vtkTypeMacro(thisClass, superclass)
Read a OpenQube readable file and output a vtkMolecule object.
static vtkDataReader * New()
void PrintSelf(ostream &os, vtkIndent indent)
helper superclass for objects that read vtk data files
virtual int FillOutputPortInformation(int port, vtkInformation *info)
#define VTKDOMAINSCHEMISTRY_EXPORT
a simple class to control print indentation
#define vtkGetStringMacro(name)
#define vtkBooleanMacro(name, type)
OpenQube::BasisSet * BasisSet
#define vtkSetMacro(name, type)