source:
src/Descriptors/MoleculeOrderDescriptor_impl.hpp@
ff4fff9
| Last change on this file since ff4fff9 was 97445f, checked in by , 11 years ago | |
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| File size: 784 bytes | |
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| [92d756] | 1 | #ifndef MOLECULEORDERDESCRIPTOR_IMPL_HPP |
| 2 | #define MOLECULEORDERDESCRIPTOR_IMPL_HPP | |
| 3 | ||
| [56f73b] | 4 | // include config.h |
| 5 | #ifdef HAVE_CONFIG_H | |
| 6 | #include <config.h> | |
| 7 | #endif | |
| 8 | ||
| 9 | ||
| [92d756] | 10 | #include "Descriptors/MoleculeDescriptor_impl.hpp" |
| 11 | ||
| 12 | class MoleculeOrderDescriptor_impl : public MoleculeDescriptor_impl | |
| 13 | { | |
| 14 | public: | |
| 15 | MoleculeOrderDescriptor_impl(int _id); | |
| 16 | virtual ~MoleculeOrderDescriptor_impl(); | |
| 17 | ||
| [97445f] | 18 | bool predicate(const std::pair<moleculeId_t,const molecule*> _molecule) const; |
| [92d756] | 19 | |
| 20 | protected: | |
| 21 | virtual molecule *find(); | |
| [97445f] | 22 | virtual const molecule *find() const; |
| [92d756] | 23 | virtual std::vector<molecule*> findAll(); |
| [97445f] | 24 | virtual std::vector<const molecule*> findAll() const; |
| [ea7a50] | 25 | |
| 26 | World::MoleculeSet& getMolecules(); | |
| [97445f] | 27 | const World::MoleculeSet& getMolecules() const; |
| [ea7a50] | 28 | |
| [92d756] | 29 | private: |
| 30 | int id; | |
| 31 | }; | |
| 32 | ||
| 33 | #endif //MOLECULEORDERDESCRIPTOR_IMPL_HPP |
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