Candidate_v1.6.1
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1 | /*
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2 | * ConnectedSubgraph.hpp
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3 | *
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4 | * Created on: Feb 16, 2011
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5 | * Author: heber
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6 | */
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7 |
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8 | #ifndef DISCONNECTEDSUBGRAPH_HPP_
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9 | #define DISCONNECTEDSUBGRAPH_HPP_
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10 |
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11 | // include config.h
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12 | #ifdef HAVE_CONFIG_H
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13 | #include <config.h>
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14 | #endif
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15 |
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16 | #include <list>
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17 | #include <iosfwd>
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18 |
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19 | class atom;
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20 | class molecule;
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21 |
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22 | typedef std::list<atom *> AtomList;
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23 |
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24 | class ConnectedSubgraph : public AtomList
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25 | {
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26 | public:
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27 | ConnectedSubgraph();
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28 | ~ConnectedSubgraph();
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29 |
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30 | /** Create a new molecule in the World and add all contained atoms.
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31 | *
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32 | * @return pointer to filled molecule
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33 | */
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34 | molecule * getMolecule() const;
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35 |
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36 | private:
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37 | };
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38 |
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39 | std::ostream & operator<<(std::ostream &ost, const ConnectedSubgraph &graph);
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40 |
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41 | #endif /* DISCONNECTEDSUBGRAPH_HPP_ */
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