Action_Thermostats
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.1
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
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Last change
on this file since 7516f6 was 97445f, checked in by Frederik Heber <heber@…>, 10 years ago |
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World::getMolecules..() now has const versions as well.
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Property mode
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100644
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File size:
528 bytes
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| 1 | #ifndef MOLECULENAMEDESCRIPTOR_IMPL_HPP
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| 2 | #define MOLECULENAMEDESCRIPTOR_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/MoleculeDescriptor_impl.hpp"
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| 11 |
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| 12 | class MoleculeNameDescriptor_impl : public MoleculeDescriptor_impl
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| 13 | {
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| 14 | public:
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| 15 | MoleculeNameDescriptor_impl(std::string _name);
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| 16 | virtual ~MoleculeNameDescriptor_impl();
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| 17 |
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| 18 | bool predicate(const std::pair<moleculeId_t,const molecule*> molecule) const;
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| 19 |
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| 20 | private:
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| 21 | std::string name;
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| 22 | };
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| 23 |
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| 24 | #endif //MOLECULENAMEDESCRIPTOR_IMPL_HPP
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