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100 lines
2.2 KiB
C
100 lines
2.2 KiB
C
3 weeks ago
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/*=========================================================================
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Program: Visualization Toolkit
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Module: vtkBond.h
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Copyright (c) Ken Martin, Will Schroeder, Bill Lorensen
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All rights reserved.
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See Copyright.txt or http://www.kitware.com/Copyright.htm for details.
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This software is distributed WITHOUT ANY WARRANTY; without even
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the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR
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PURPOSE. See the above copyright notice for more information.
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=========================================================================*/
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/**
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* @class vtkBond
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* @brief convenience proxy for vtkMolecule
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*
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*/
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#ifndef vtkBond_h
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#define vtkBond_h
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#include "vtkAtom.h" // For vtkAtom
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#include "vtkCommonDataModelModule.h" // For export macro
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#include "vtkObject.h" // For macros, etc
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class vtkMolecule;
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class VTKCOMMONDATAMODEL_EXPORT vtkBond
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{
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public:
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void PrintSelf(ostream& os, vtkIndent indent);
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/**
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* Return the Id used to identify this bond in the parent molecule.
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*/
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vtkIdType GetId() const;
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/**
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* Return the parent molecule of this bond.
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*/
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vtkMolecule* GetMolecule();
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//@{
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/**
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* Get the starting / ending atom ids for this bond.
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*/
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vtkIdType GetBeginAtomId() const;
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vtkIdType GetEndAtomId() const;
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//@}
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//@{
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/**
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* Get a vtkAtom object that refers to the starting / ending atom
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* for this bond.
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*/
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vtkAtom GetBeginAtom();
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vtkAtom GetEndAtom();
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vtkAtom GetBeginAtom() const;
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vtkAtom GetEndAtom() const;
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//@}
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/**
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* Get the bond order for this bond.
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*/
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unsigned short GetOrder();
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/**
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* Get the distance between the bonded atoms.
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* @note This function is faster than vtkMolecule::GetBondLength and
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* should be used when possible.
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*/
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double GetLength() const;
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protected:
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friend class vtkMolecule;
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vtkBond(vtkMolecule* parent, vtkIdType id, vtkIdType beginAtomId, vtkIdType endAtomId);
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vtkMolecule* Molecule;
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vtkIdType Id;
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vtkIdType BeginAtomId;
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vtkIdType EndAtomId;
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};
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inline vtkIdType vtkBond::GetId() const
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{
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return this->Id;
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}
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inline vtkMolecule* vtkBond::GetMolecule()
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{
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return this->Molecule;
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}
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#endif
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// VTK-HeaderTest-Exclude: vtkBond.h
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