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
        Example_ManyWaysToTranslateAtom
        Exclude_Hydrogens_annealWithBondGraph
        Fix_Verbose_Codepatterns
        ForceAnnealing_oldresults
        ForceAnnealing_with_BondGraph
        ForceAnnealing_with_BondGraph_continued
        ForceAnnealing_with_BondGraph_continued_betteresults
        ForceAnnealing_with_BondGraph_contraction-expansion
        Gui_displays_atomic_force_velocity
        IndependentFragmentGrids_IntegrationTest
        JobMarket_RobustOnKillsSegFaults
        JobMarket_StableWorkerPool
        PythonUI_with_named_parameters
        Recreated_GuiChecks
        StoppableMakroAction
        TremoloParser_IncreasedPrecision
        TremoloParser_MultipleTimesteps
        stable
      
      
        
          | 
            Last change
 on this file since 95b64f was             34af97, checked in by Frederik Heber <heber@…>, 9 years ago           | 
        
        
          | 
             
FIX: KeySetsContainer::insert(KeySetsContainer&) was not fully working. 
 
- sets were simply appended and according to their index sets.
 - this works for normal index sets but not for forceindexsets, which have the
additional (excluded) hydrogens that take not part when counting the bond
order.
 - As FragmentationResultsContainer relied on index and forceindex to have the
same fragment order, this was no longer true.
 - Added extensive unit test on KeySetsContainer::insert().
  
           | 
        
        
          
            
              - 
Property                 mode
 set to                 
100644
               
             
           | 
        
        
          | 
            File size:
            1.1 KB
           | 
        
      
      
| Rev | Line |   | 
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| [feb7df] | 1 | /*
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 | 2 |  * KeySetsContainerUnitTest.hpp
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 | 3 |  *
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 | 4 |  *  Created on: Sep 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 KEYSETSCONTAINERUNITTEST_HPP_
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 | 9 | #define KEYSETSCONTAINERUNITTEST_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 | 
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 | 17 | #include <cppunit/extensions/HelperMacros.h>
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 | 18 | 
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 | 19 | class KeySetsContainer;
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 | 20 | 
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 | 21 | /********************************************** Test classes **************************************/
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 | 22 | 
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 | 23 | class KeySetsContainerTest : public CppUnit::TestFixture
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 | 24 | {
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 | 25 |     CPPUNIT_TEST_SUITE( KeySetsContainerTest) ;
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| [1b145f] | 26 |     CPPUNIT_TEST ( EqualityTest );
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| [feb7df] | 27 |     CPPUNIT_TEST ( SerializationTest );
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| [34af97] | 28 |     CPPUNIT_TEST ( insertIntoEmptyTest );
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 | 29 |     CPPUNIT_TEST ( insertEmptyIntoTest );
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 | 30 |     CPPUNIT_TEST ( insertSmallerIntoTest );
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 | 31 |     CPPUNIT_TEST ( insertLargerIntoTest );
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| [feb7df] | 32 |     CPPUNIT_TEST_SUITE_END();
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 | 33 | 
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 | 34 | public:
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 | 35 |       void setUp();
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 | 36 |       void tearDown();
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| [1b145f] | 37 |       void EqualityTest();
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| [feb7df] | 38 |       void SerializationTest();
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| [34af97] | 39 |       void insertIntoEmptyTest();
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 | 40 |       void insertEmptyIntoTest();
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 | 41 |       void insertSmallerIntoTest();
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 | 42 |       void insertLargerIntoTest();
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| [feb7df] | 43 | 
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 | 44 | private:
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 | 45 |       KeySetsContainer *Keys;
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 | 46 | 
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 | 47 | };
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 | 48 | 
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 | 49 | #endif /* KEYSETSCONTAINERUNITTEST_HPP_ */
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