source: src/unittests@ 3839e5

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
Name Size Rev Age Author Last Change
../
ActionSequenceTest.cpp 5.9 KB ​ 2efa90   15 years Till Crueger Added detailed documentation for the Action class
ActionSequenceTest.hpp 865 bytes ​ 0229f9   15 years Till Crueger Added more tests for Actionsequence - Test if every included object …
ActOnAllUnitTest.cpp 3.4 KB ​ 36166d   14 years Till Crueger Removed left over parts from old memory-tracker
ActOnAllUnitTest.hpp 920 bytes ​ 0a4f7f   15 years Till Crueger Made data internal data-structure of vector class private - Replaced …
analysisbondsunittest.cpp 5.2 KB ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
analysisbondsunittest.hpp 963 bytes ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
AnalysisCorrelationToPointUnitTest.cpp 3.6 KB ​ c78d44   15 years FrederikHeber Change to PairCorrelation...() functions, accept now vector<element *> …
AnalysisCorrelationToPointUnitTest.hpp 1.1 KB ​ c78d44   15 years FrederikHeber Change to PairCorrelation...() functions, accept now vector<element *> …
AnalysisCorrelationToSurfaceUnitTest.cpp 7.4 KB ​ c78d44   15 years FrederikHeber Change to PairCorrelation...() functions, accept now vector<element *> …
AnalysisCorrelationToSurfaceUnitTest.hpp 1.6 KB ​ c78d44   15 years FrederikHeber Change to PairCorrelation...() functions, accept now vector<element *> …
AnalysisPairCorrelationUnitTest.cpp 3.7 KB ​ c78d44   15 years FrederikHeber Change to PairCorrelation...() functions, accept now vector<element *> …
AnalysisPairCorrelationUnitTest.hpp 1.1 KB ​ c78d44   15 years FrederikHeber Change to PairCorrelation...() functions, accept now vector<element *> …
AtomDescriptorTest.cpp 4.9 KB ​ 229e3c   15 years Till Crueger Added custom Assert makro that allows ignoring asserts
AtomDescriptorTest.hpp 718 bytes ​ ead4e6   15 years Till Crueger Made the periodentafel use STL-containers instead of custom llists
atomsCalculationTest.cpp 2.7 KB ​ 229e3c   15 years Till Crueger Added custom Assert makro that allows ignoring asserts
atomsCalculationTest.hpp 704 bytes ​ ead4e6   15 years Till Crueger Made the periodentafel use STL-containers instead of custom llists
bondgraphunittest.cpp 4.7 KB ​ 920c70   15 years FrederikHeber Removed all Malloc/Calloc/ReAlloc (&Free) and replaced by new and …
bondgraphunittest.hpp 1.1 KB ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
CacheableTest.cpp 1.8 KB ​ f8e486   15 years Till Crueger Repaired compilation with -DNO_CACHING option
CacheableTest.hpp 509 bytes ​ e3c8b4   15 years Till Crueger Added data structure to allow caching of derived values
CountBondsUnitTest.cpp 8.3 KB ​ 920c70   15 years FrederikHeber Removed all Malloc/Calloc/ReAlloc (&Free) and replaced by new and …
CountBondsUnitTest.hpp 1.0 KB ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
gslmatrixsymmetricunittest.cpp 6.5 KB ​ 9b6b2f   15 years FrederikHeber Tests now work with Eclipse ECUT's TestRunner. - new switch in …
gslmatrixsymmetricunittest.hpp 881 bytes ​ fc3b67   15 years FrederikHeber Wrapper class for gsl_matrix along with working Unit test. - new …
gslmatrixunittest.cpp 6.2 KB ​ 9b6b2f   15 years FrederikHeber Tests now work with Eclipse ECUT's TestRunner. - new switch in …
gslmatrixunittest.hpp 863 bytes ​ fc3b67   15 years FrederikHeber Wrapper class for gsl_matrix along with working Unit test. - new …
gslvectorunittest.cpp 3.5 KB ​ b11d3b   15 years FrederikHeber Added operators and state checkers to GSLVector. - added operators …
gslvectorunittest.hpp 935 bytes ​ b11d3b   15 years FrederikHeber Added operators and state checkers to GSLVector. - added operators …
infounittest.cpp 929 bytes ​ e6fdbe   15 years FrederikHeber MEMLEAK: In many tests World, MemoryUsageObserver, logger or …
infounittest.hpp 569 bytes ​ 8725ed   15 years FrederikHeber New Info class that contains a global verbosity level, increased per …
linearsystemofequationsunittest.cpp 2.5 KB ​ 3dcb1f   15 years Till Crueger Added two functions to Box class to translate Vectors from Box-Space …
linearsystemofequationsunittest.hpp 946 bytes ​ f60610   15 years FrederikHeber Wrapper class for gsl_linalg along with working Unit test. - new …
LineUnittest.cpp 12.5 KB ​ 3dcb1f   15 years Till Crueger Added two functions to Box class to translate Vectors from Box-Space …
LineUnittest.hpp 899 bytes ​ f932b7   15 years Till Crueger Added a method to calculate the intersection of a line with the unit sphere
LinkedCellUnitTest.cpp 11.9 KB ​ 4ac1aa   15 years FrederikHeber Removed two unused variables.
LinkedCellUnitTest.hpp 1.3 KB ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
listofbondsunittest.cpp 7.5 KB ​ f8e486   15 years Till Crueger Repaired compilation with -DNO_CACHING option
listofbondsunittest.hpp 1.1 KB ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
logunittest.cpp 1.4 KB ​ a67d19   15 years FrederikHeber Huge change: Log() << Verbose(.) --> DoLog(.) && (Log() << Verbose(.) …
logunittest.hpp 459 bytes ​ 06c7a3   15 years Saskia Metzler Ticket 43 Create a logging class The verbosity level can now be …
Makefile.am 8.0 KB ​ 0eb2dc   14 years Till Crueger Added comparison Operator to matrix class
manipulateAtomsTest.cpp 3.1 KB ​ 6d574a   15 years Till Crueger Replaced several old-style asserts with more usable ASSERTs
manipulateAtomsTest.hpp 702 bytes ​ afb47f   15 years Till Crueger Added a mechanism that allows the world to track changes done by the …
MapofActionsTest.cpp 2.1 KB ​ 97ebf8   15 years FrederikHeber Added all commands defined in ParseCommandLineOptions() as Actions. - …
MapofActionsTest.hpp 795 bytes ​ 97ebf8   15 years FrederikHeber Added all commands defined in ParseCommandLineOptions() as Actions. - …
MatrixUnittest.cpp 8.2 KB ​ 5630bd   14 years Till Crueger Added Unittests for the matrix class
MatrixUnittest.hpp 889 bytes ​ 5630bd   14 years Till Crueger Added Unittests for the matrix class
memoryallocatorunittest.cpp 2.0 KB ​ 920c70   15 years FrederikHeber Removed all Malloc/Calloc/ReAlloc (&Free) and replaced by new and …
memoryallocatorunittest.hpp 703 bytes ​ be90f1   15 years Saskia Metzler temp commit
memoryusageobserverunittest.cpp 5.1 KB ​ 1ec0ac   15 years FrederikHeber MEMLEAK: Lots of Free() have been forgotten after Malloc's at start of …
memoryusageobserverunittest.hpp 1.6 KB ​ be90f1   15 years Saskia Metzler temp commit
MoleculeDescriptorTest.cpp 5.6 KB ​ 23b547   15 years Till Crueger Added generic singleton Pattern that can be inherited to any class …
MoleculeDescriptorTest.hpp 798 bytes ​ ead4e6   15 years Till Crueger Made the periodentafel use STL-containers instead of custom llists
ObserverTest.cpp 12.2 KB ​ 8774c5   14 years Till Crueger Added operator-> for Observed Iterators
ObserverTest.hpp 1.6 KB ​ 8774c5   14 years Till Crueger Added operator-> for Observed Iterators
ParserUnitTest.cpp 11.7 KB ​ 2fd80b5   15 years FrederikHeber FIXES: ParserUnitTest was broken - XyzParser: ctime returns endline, …
ParserUnitTest.hpp 1.2 KB ​ 1b2d30   15 years FrederikHeber Extended PcpParser, completed MpqcParser. - BUGFIX: …
periodentafelTest.cpp 2.7 KB ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
periodentafelTest.hpp 786 bytes ​ 4eb4fe   15 years FrederikHeber "-e <db path>" not necessary anymore. Removed necessity of specifying …
PlaneUnittest.cpp 6.7 KB ​ 3dcb1f   15 years Till Crueger Added two functions to Box class to translate Vectors from Box-Space …
PlaneUnittest.hpp 856 bytes ​ 27ac00   15 years Till Crueger Made the line-plane intersection method take a line instead of two vectors
ShapeUnittest.cpp 12.3 KB ​ 997784   15 years Till Crueger Added basic structure for definition of geometric 3D shapes.
ShapeUnittest.hpp 1.1 KB ​ 997784   15 years Till Crueger Added basic structure for definition of geometric 3D shapes.
SingletonTest.cpp 4.5 KB ​ b8d4a3   15 years Saskia Metzler Tremolo format parser
SingletonTest.hpp 450 bytes ​ d25863   15 years Till Crueger Added Unittest for Singleton pattern
stackclassunittest.cpp 2.0 KB ​ 920c70   15 years FrederikHeber Removed all Malloc/Calloc/ReAlloc (&Free) and replaced by new and …
stackclassunittest.hpp 760 bytes ​ 8c5327   15 years FrederikHeber Added Unit test for StackClass. - was former …
tesselation_boundarytriangleunittest.cpp 6.9 KB ​ 920c70   15 years FrederikHeber Removed all Malloc/Calloc/ReAlloc (&Free) and replaced by new and …
tesselation_boundarytriangleunittest.hpp 1.1 KB ​ 734816   15 years FrederikHeber LinkedNodes is now declared inside LinkedCell and some new functions. …
tesselation_insideoutsideunittest.cpp 5.4 KB ​ 36166d   14 years Till Crueger Removed left over parts from old memory-tracker
tesselation_insideoutsideunittest.hpp 944 bytes ​ 734816   15 years FrederikHeber LinkedNodes is now declared inside LinkedCell and some new functions. …
tesselationunittest.cpp 6.4 KB ​ 920c70   15 years FrederikHeber Removed all Malloc/Calloc/ReAlloc (&Free) and replaced by new and …
tesselationunittest.hpp 946 bytes ​ 734816   15 years FrederikHeber LinkedNodes is now declared inside LinkedCell and some new functions. …
TestRunnerMain.cpp 452 bytes ​ c39cc4   15 years FrederikHeber TestRunnerMain.cpp admonished missing TestRunner despite no HAVE_ECUT. …
UnitTestMain.cpp 1018 bytes ​ c39cc4   15 years FrederikHeber TestRunnerMain.cpp admonished missing TestRunner despite no HAVE_ECUT. …
vectorunittest.cpp 6.8 KB ​ 36166d   14 years Till Crueger Removed left over parts from old memory-tracker
vectorunittest.hpp 1.4 KB ​ c550dd   14 years Till Crueger Removed the VectorIsInParallelepiped in favor of more general methods …
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