27 #include "vtkCommonDataModelModule.h"
37 void PrintSelf(ostream &os,
vtkIndent indent);
53 unsigned short GetAtomicNumber()
const;
54 void SetAtomicNumber(
unsigned short atomicNum);
61 void GetPosition(
float pos[3])
const;
62 void GetPosition(
double pos[3])
const;
63 void SetPosition(
const float pos[3]);
64 void SetPosition(
float x,
float y,
float z);
class describing a molecule
a simple class to control print indentation
vtkMolecule * GetMolecule()
Return the parent molecule of this atom.
convenience proxy for vtkMolecule
vtkIdType GetId() const
Return the Id used to identify this atom in the parent molecule.