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Last change
on this file since 97dff0 was b49568, checked in by Frederik Heber <heber@…>, 13 years ago |
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Added new descriptor AtomOfMolecule.
- also added new unit test function.
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Property mode
set to
100644
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File size:
500 bytes
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| 1 | #ifndef ATOMOFMOLECULEDESCRIPTOR_IMPL_HPP
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| 2 | #define ATOMOFMOLECULEDESCRIPTOR_IMPL_HPP
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| 3 |
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| 4 | // include config.h
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| 5 | #ifdef HAVE_CONFIG_H
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| 6 | #include <config.h>
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| 7 | #endif
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| 8 |
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| 9 |
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| 10 | #include "Descriptors/AtomDescriptor_impl.hpp"
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| 11 |
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| 12 | class AtomOfMoleculeDescriptor_impl : public AtomDescriptor_impl
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| 13 | {
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| 14 | public:
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| 15 | AtomOfMoleculeDescriptor_impl(moleculeId_t _id);
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| 16 | virtual ~AtomOfMoleculeDescriptor_impl();
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| 17 |
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| 18 | bool predicate(std::pair<atomId_t,atom*> atom);
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| 19 |
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| 20 | private:
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| 21 | moleculeId_t id;
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| 22 | };
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| 23 |
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| 24 | #endif //ATOMOFMOLECULEDESCRIPTOR_IMPL_HPP
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