VTK  9.1.0
vtkPointSetToMoleculeFilter.h
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1/*=========================================================================
2
3 Program: Visualization Toolkit
4 Module: vtkPointSetToMoleculeFilter.h
5
6 Copyright (c) Ken Martin, Will Schroeder, Bill Lorensen
7 All rights reserved.
8 See Copyright.txt or http://www.kitware.com/Copyright.htm for details.
9
10 This software is distributed WITHOUT ANY WARRANTY; without even
11 the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR
12 PURPOSE. See the above copyright notice for more information.
13
14=========================================================================*/
15/*
16 * @class vtkPointSetToMoleculeFilter
17 * @brief Converts a pointset into a molecule.
18 *
19 * vtkPointSetToMoleculeFilter is a filter that takes a vtkPointSet as input
20 * and generates a vtkMolecule.
21 * Each point of the given vtkPointSet will become an atom of the vtkMolecule.
22 * The vtkPointSet should provide a point data array (default is scalar one)
23 * to specify the atomic number of each atom.
24 */
25
26#ifndef vtkPointSetToMoleculeFilter_h
27#define vtkPointSetToMoleculeFilter_h
28
29#include "vtkDomainsChemistryModule.h" // For export macro
31
32class VTKDOMAINSCHEMISTRY_EXPORT vtkPointSetToMoleculeFilter : public vtkMoleculeAlgorithm
33{
34public:
37 void PrintSelf(ostream& os, vtkIndent indent) override;
38
40
45 vtkGetMacro(ConvertLinesIntoBonds, bool);
46 vtkSetMacro(ConvertLinesIntoBonds, bool);
47 vtkBooleanMacro(ConvertLinesIntoBonds, bool);
49
50protected:
52 ~vtkPointSetToMoleculeFilter() override = default;
53
54 int FillInputPortInformation(int port, vtkInformation* info) override;
55
57
59
60private:
62 void operator=(const vtkPointSetToMoleculeFilter&) = delete;
63};
64
65#endif
a simple class to control print indentation
Definition: vtkIndent.h:113
Store zero or more vtkInformation instances.
Store vtkAlgorithm input/output information.
Superclass for algorithms that operate on vtkMolecules.
int RequestData(vtkInformation *, vtkInformationVector **, vtkInformationVector *) override
This is called by the superclass.
~vtkPointSetToMoleculeFilter() override=default
int FillInputPortInformation(int port, vtkInformation *info) override
Fill the input port information objects for this algorithm.
static vtkPointSetToMoleculeFilter * New()
void PrintSelf(ostream &os, vtkIndent indent) override
Methods invoked by print to print information about the object including superclasses.