Changeset db11d4 for src/Fragmentation/Summation/unittests

Timestamp:

Nov 16, 2012, 2:13:44 PM (12 years ago)

Author:

Frederik Heber <heber@…>

Branches:

Action_Thermostats, Add_AtomRandomPerturbation, Add_FitFragmentPartialChargesAction, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Added_ParseSaveFragmentResults, AddingActions_SaveParseParticleParameters, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_ParticleName_to_Atom, Adding_StructOpt_integration_tests, AtomFragments, Automaking_mpqc_open, AutomationFragmentation_failures, Candidate_v1.5.4, Candidate_v1.6.0, Candidate_v1.6.1, ChangeBugEmailaddress, ChangingTestPorts, ChemicalSpaceEvaluator, CombiningParticlePotentialParsing, Combining_Subpackages, Debian_Package_split, Debian_package_split_molecuildergui_only, Disabling_MemDebug, Docu_Python_wait, EmpiricalPotential_contain_HomologyGraph, EmpiricalPotential_contain_HomologyGraph_documentation, Enable_parallel_make_install, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, FitPartialCharges_GlobalError, Fix_BoundInBox_CenterInBox_MoleculeActions, Fix_ChargeSampling_PBC, Fix_ChronosMutex, Fix_FitPartialCharges, Fix_FitPotential_needs_atomicnumbers, Fix_ForceAnnealing, Fix_IndependentFragmentGrids, Fix_ParseParticles, Fix_ParseParticles_split_forward_backward_Actions, Fix_PopActions, Fix_QtFragmentList_sorted_selection, Fix_Restrictedkeyset_FragmentMolecule, Fix_StatusMsg, Fix_StepWorldTime_single_argument, Fix_Verbose_Codepatterns, Fix_fitting_potentials, Fixes, ForceAnnealing_goodresults, ForceAnnealing_oldresults, ForceAnnealing_tocheck, ForceAnnealing_with_BondGraph, ForceAnnealing_with_BondGraph_continued, ForceAnnealing_with_BondGraph_continued_betteresults, ForceAnnealing_with_BondGraph_contraction-expansion, FragmentAction_writes_AtomFragments, FragmentMolecule_checks_bonddegrees, GeometryObjects, Gui_Fixes, Gui_displays_atomic_force_velocity, ImplicitCharges, IndependentFragmentGrids, IndependentFragmentGrids_IndividualZeroInstances, IndependentFragmentGrids_IntegrationTest, IndependentFragmentGrids_Sole_NN_Calculation, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, JobMarket_unresolvable_hostname_fix, MoreRobust_FragmentAutomation, ODR_violation_mpqc_open, PartialCharges_OrthogonalSummation, PdbParser_setsAtomName, PythonUI_with_named_parameters, QtGui_reactivate_TimeChanged_changes, Recreated_GuiChecks, Rewrite_FitPartialCharges, RotateToPrincipalAxisSystem_UndoRedo, SaturateAtoms_findBestMatching, SaturateAtoms_singleDegree, StoppableMakroAction, Subpackage_CodePatterns, Subpackage_JobMarket, Subpackage_LinearAlgebra, Subpackage_levmar, Subpackage_mpqc_open, Subpackage_vmg, Switchable_LogView, ThirdParty_MPQC_rebuilt_buildsystem, TrajectoryDependenant_MaxOrder, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps, TremoloParser_setsAtomName, Ubuntu_1604_changes, stable

Children:

d199cc

Parents:

a3a382

git-author:

Frederik Heber <heber@…> (08/03/12 07:54:39)

git-committer:

Frederik Heber <heber@…> (11/16/12 14:13:44)

Message:

Added SubsetMap::getMaximumSubsetLevel() to know up to which level to sum.

• also added unit test function.

Location:

src/Fragmentation/Summation/unittests

Files:

• SubsetMapUnitTest.cpp (modified) (1 diff)
• SubsetMapUnitTest.hpp (modified) (2 diffs)

src/Fragmentation/Summation/unittests/SubsetMapUnitTest.cpp

@@ -300 +300 @@
   }
 }
+
+/** UnitTest for getMaximumSubsetLevel()
+ */
+void SubsetMapTest::getMaximumSubsetLevelTest()
+{
+  // create small container
+  {
+    IndexSet tempset;
+    std::vector<IndexSet> sets;
+    sets.push_back(tempset);
+    tempset += 1;
+    sets.push_back(tempset);
+    tempset += 2;
+    sets.push_back(tempset);
+    tempset.clear();
+    tempset += 2;
+    sets.push_back(tempset);
+    IndexSetContainer container( sets );
+    // now we have {}, {1}, {2}, {1,2} in container
+
+    SM = new SubsetMap(container);
+    CPPUNIT_ASSERT( SM != NULL );
+
+    CPPUNIT_ASSERT_EQUAL( (size_t)1, SM->getMaximumSubsetLevel() );
+    // we are strictly less than super set (last one)
+    CPPUNIT_ASSERT( SM->getMaximumSubsetLevel() < (--SM->Lookup.end())->first->size() );
+  }
+
+  // create larger container
+  {
+    IndexSetContainer container( allsets );
+    delete SM;
+    SM = new SubsetMap(container);
+    CPPUNIT_ASSERT( SM != NULL );
+
+    CPPUNIT_ASSERT_EQUAL( (size_t)3, SM->getMaximumSubsetLevel() );
+    CPPUNIT_ASSERT( SM->getMaximumSubsetLevel() < (--SM->Lookup.end())->first->size() );
+  }
+}

src/Fragmentation/Summation/unittests/SubsetMapUnitTest.hpp

@@ -31 +31 @@
     CPPUNIT_TEST ( getSubsetTest );
     CPPUNIT_TEST ( gatherSubsetTest );
+    CPPUNIT_TEST ( getMaximumSubsetLevelTest );
     CPPUNIT_TEST_SUITE_END();
 
@@ -40 +41 @@
       void getSubsetTest();
       void gatherSubsetTest();
+      void getMaximumSubsetLevelTest();
 
 private: