Action_Thermostats
        Adding_Graph_to_ChangeBondActions
        Adding_MD_integration_tests
        Adding_StructOpt_integration_tests
        AutomationFragmentation_failures
        Candidate_v1.6.1
        Candidate_v1.7.0
        ChemicalSpaceEvaluator
        Enhanced_StructuralOptimization
        Enhanced_StructuralOptimization_continued
        Exclude_Hydrogens_annealWithBondGraph
        Fix_Verbose_Codepatterns
        ForceAnnealing_with_BondGraph
        ForceAnnealing_with_BondGraph_continued
        ForceAnnealing_with_BondGraph_continued_betteresults
        ForceAnnealing_with_BondGraph_contraction-expansion
        Gui_displays_atomic_force_velocity
        JobMarket_RobustOnKillsSegFaults
        JobMarket_StableWorkerPool
        PythonUI_with_named_parameters
        Recreated_GuiChecks
        StoppableMakroAction
        TremoloParser_IncreasedPrecision
        stable
      
      
      
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| 1 | /*
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| 2 |  * FragmentEdge.hpp
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| 3 |  *
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| 4 |  *  Created on: Sep 24, 2012
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| 5 |  *      Author: heber
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| 6 |  */
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| 7 | 
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| 8 | #ifndef FRAGMENTEDGE_HPP_
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| 9 | #define FRAGMENTEDGE_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 <boost/serialization/export.hpp>
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| 17 | #include <boost/serialization/utility.hpp>
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| 18 | 
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| 19 | #include <iosfwd>
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| 20 | #include <utility>
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| 21 | 
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| 22 | class FragmentEdge
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| 23 | {
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| 24 |   //!> grant output operator access to internals
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| 25 |   friend std::ostream& operator<<(std::ostream &out, const FragmentEdge &node);
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| 26 | public:
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| 27 |   typedef std::pair<size_t, size_t> AtomicNumberPair_t;
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| 28 | 
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| 29 |   FragmentEdge();
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| 30 |   FragmentEdge(const AtomicNumberPair_t &_pair);
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| 31 |   FragmentEdge(const size_t _left, const size_t _right);
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| 32 |   ~FragmentEdge()
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| 33 |   {}
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| 34 | 
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| 35 |   FragmentEdge& operator=(const FragmentEdge &edge);
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| 36 | 
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| 37 |   bool operator<(const FragmentEdge &edge) const;
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| 38 |   bool operator>(const FragmentEdge &edge) const;
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| 39 |   bool operator==(const FragmentEdge &edge) const;
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| 40 |   bool operator!=(const FragmentEdge &edge) const {
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| 41 |     return (!(*this == edge));
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| 42 |   }
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| 43 | 
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| 44 | private:
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| 45 |   //!> stores the atomic number of either FragmentNode making up the edge
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| 46 |   const AtomicNumberPair_t AtomicNumberPair;
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| 47 | 
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| 48 | private:
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| 49 |   friend class boost::serialization::access;
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| 50 |   // serialization
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| 51 |   template <typename Archive>
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| 52 |   void serialize(Archive& ar, const unsigned int version)
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| 53 |   {
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| 54 |     ar & const_cast<AtomicNumberPair_t &>(AtomicNumberPair);
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| 55 |   }
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| 56 | };
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| 57 | 
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| 58 | // we need to give this class a unique key for serialization
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| 59 | BOOST_CLASS_EXPORT_KEY(FragmentEdge)
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| 60 | 
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| 61 | std::ostream& operator<<(std::ostream &out, const FragmentEdge &node);
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| 62 | 
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| 63 | #endif /* FRAGMENTEDGE_HPP_ */
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