source:
src/Descriptors/MoleculeSelectionDescriptor_impl.hpp
Last change on this file was 97445f, checked in by , 9 years ago | |
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1 | /* |
2 | * MoleculeSelectionDescriptor_impl.hpp |
3 | * |
4 | * Created on: Jul 16, 2010 |
5 | * Author: crueger |
6 | */ |
7 | |
8 | #ifndef MOLECULESELECTIONDESCRIPTOR_IMPL_HPP_ |
9 | #define MOLECULESELECTIONDESCRIPTOR_IMPL_HPP_ |
10 | |
11 | // include config.h |
12 | #ifdef HAVE_CONFIG_H |
13 | #include <config.h> |
14 | #endif |
15 | |
16 | |
17 | #include "Descriptors/MoleculeDescriptor_impl.hpp" |
18 | |
19 | class MoleculeSelectionDescriptor_impl : public MoleculeDescriptor_impl{ |
20 | public: |
21 | MoleculeSelectionDescriptor_impl(); |
22 | virtual ~MoleculeSelectionDescriptor_impl(); |
23 | bool predicate(const std::pair<moleculeId_t,const molecule*> molecule) const; |
24 | protected: |
25 | // need to overide more than the standard methods to make this fast |
26 | virtual molecule *find(); |
27 | virtual const molecule *find() const; |
28 | virtual std::vector<molecule*> findAll(); |
29 | virtual std::vector<const molecule*> findAll() const; |
30 | |
31 | World::MoleculeSet& getSelectedMolecules(); |
32 | const World::MoleculeSet& getSelectedMolecules() const; |
33 | }; |
34 | |
35 | #endif /* MOLECULESELECTIONDESCRIPTOR_IMPL_HPP_ */ |
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