Changeset b9907c
- Timestamp:
- Oct 7, 2009, 3:35:17 PM (16 years ago)
- 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:
- 87e2e39
- Parents:
- be90f1
- Files:
-
- 4 edited
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- Unmodified
- Added
- Removed
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Makefile.am
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rbe90f1 rb9907c 1 1 ACLOCAL_AMFLAGS = -I m4 2 SUBDIRS = src doc tests2 SUBDIRS = src src/unittests doc tests 3 3 4 4 EXTRA_DIST = autogen.sh -
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configure.ac
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rbe90f1 rb9907c 14 14 AC_PROG_CXX 15 15 AC_PROG_CC 16 AC_PROG_RANLIB 16 17 AC_PROG_INSTALL 17 18 AC_CHECK_PROG([LATEX],[latex],[latex],[:]) -
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src/Makefile.am
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rbe90f1 rb9907c 1 SUBDIRS = unittests 1 SOURCE = atom.cpp bond.cpp boundary.cpp config.cpp element.cpp ellipsoid.cpp helpers.cpp leastsquaremin.cpp linkedcell.cpp memoryusageobserver.cpp molecules.cpp moleculelist.cpp parser.cpp periodentafel.cpp tesselation.cpp tesselationhelpers.cpp vector.cpp verbose.cpp 2 HEADER = atom.hpp bond.hpp boundary.hpp config.hpp defs.hpp element.hpp ellipsoid.hpp helpers.hpp leastsquaremin.hpp linkedcell.hpp memoryusageobserver.hpp molecules.hpp parser.hpp periodentafel.hpp stackclass.hpp tesselation.hpp tesselationhelpers.hpp vector.hpp verbose.hpp 2 3 3 SOURCE = atom.cpp bond.cpp boundary.cpp config.cpp element.cpp ellipsoid.cpp helpers.cpp leastsquaremin.cpp linkedcell.cpp moleculelist.cpp molecules.cpp parser.cpp periodentafel.cpp tesselation.cpp tesselationhelpers.cpp vector.cpp verbose.cpp 4 HEADER = atom.hpp bond.hpp boundary.hpp config.hpp defs.hpp element.hpp ellipsoid.hpp helpers.hpp leastsquaremin.hpp linkedcell.hpp memoryallocator.hpp memoryusageobserver.cpp memoryusageobserver.hpp molecules.hpp parser.hpp periodentafel.hpp stackclass.hpp tesselation.hpp tesselationhelpers.hpp vector.hpp verbose.hpp 4 INCLUDES = -I$(top_srcdir)/src/unittests 5 5 6 noinst_LIBRARIES = libmolecuilder.a 6 7 bin_PROGRAMS = molecuilder joiner analyzer 7 8 molecuilderdir = ${bindir} 9 libmolecuilder_a_SOURCES = ${SOURCE} ${HEADER} 8 10 molecuilder_DATA = elements.db valence.db orbitals.db Hbonddistance.db Hbondangle.db 9 molecuilder_SOURCES = ${SOURCE} builder.cpp ${HEADER} 10 joiner_SOURCES = joiner.cpp datacreator.cpp element.cpp helpers.cpp memoryallocator.hpp memoryusageobserver.cpp memoryusageobserver.hpp periodentafel.cpp parser.cpp verbose.cpp datacreator.hpp helpers.hpp parser.hpp periodentafel.hpp 11 analyzer_SOURCES = analyzer.cpp datacreator.cpp element.cpp helpers.cpp memoryallocator.hpp memoryusageobserver.cpp memoryusageobserver.hpp periodentafel.cpp parser.cpp verbose.cpp helpers.hpp periodentafel.hpp parser.hpp datacreator.hpp 11 molecuilder_SOURCES = builder.cpp 12 molecuilder_LDADD = libmolecuilder.a 13 joiner_SOURCES = joiner.cpp datacreator.cpp parser.cpp datacreator.hpp helpers.hpp parser.hpp periodentafel.hpp 14 joiner_LDADD = libmolecuilder.a 15 analyzer_SOURCES = analyzer.cpp datacreator.cpp parser.cpp helpers.hpp periodentafel.hpp parser.hpp datacreator.hpp 16 analyzer_LDADD = libmolecuilder.a 12 17 13 EXTRA_DIST = ${molecuilder_DATA}18 #EXTRA_DIST = ${molecuilder_DATA} -
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src/unittests/Makefile.am
rbe90f1 rb9907c 1 INCLUDES = -I$(top_srcdir)/src 2 1 3 noinst_PROGRAMS = MemoryAllocatorUnitTest MemoryUsageObserverUnitTest VectorUnitTest 2 4 3 5 TESTS = VectorUnitTest MemoryUsageObserverUnitTest MemoryAllocatorUnitTest 4 6 check_PROGRAMS = $(TESTS) 7 5 8 VectorUnitTest_SOURCES = defs.hpp helpers.hpp leastsquaremin.hpp memoryallocator.hpp memoryusageobserver.hpp vectorunittest.cpp vectorunittest.hpp vector.hpp verbose.hpp 6 9 VectorUnitTest_CXXFLAGS = $(CPPUNIT_CFLAGS) 7 10 VectorUnitTest_LDFLAGS = $(CPPUNIT_LIBS) -ldl 11 VectorUnitTest_LDADD = ../libmolecuilder.a 8 12 9 13 MemoryAllocatorUnitTest_SOURCES = defs.hpp helpers.hpp memoryallocatorunittest.cpp memoryallocatorunittest.hpp memoryallocator.hpp memoryusageobserver.hpp verbose.hpp 10 14 MemoryAllocatorUnitTest_CXXFLAGS = $(CPPUNIT_CFLAGS) -I.. 11 15 MemoryAllocatorUnitTest_LDFLAGS = $(CPPUNIT_LIBS) -ldl 16 MemoryAllocatorUnitTest_LDADD = ../libmolecuilder.a 12 17 13 18 MemoryUsageObserverUnitTest_SOURCES = defs.hpp helpers.hpp memoryusageobserverunittest.cpp memoryusageobserverunittest.hpp memoryusageobserver.hpp verbose.hpp 14 19 MemoryUsageObserverUnitTest_CXXFLAGS = $(CPPUNIT_CFLAGS) 15 20 MemoryUsageObserverUnitTest_LDFLAGS = $(CPPUNIT_LIBS) -ldl 21 MemoryUsageObserverUnitTest_LDADD = ../libmolecuilder.a
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