source: ThirdParty/mpqc_open/src/lib/chemistry/qc@ 47b463

Action_Thermostats Add_AtomRandomPerturbation Add_RotateAroundBondAction Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests AutomationFragmentation_failures Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_ChronosMutex Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion GeometryObjects Gui_displays_atomic_force_velocity IndependentFragmentGrids_IntegrationTest JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks RotateToPrincipalAxisSystem_UndoRedo StoppableMakroAction Subpackage_levmar Subpackage_vmg ThirdParty_MPQC_rebuilt_buildsystem TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps Ubuntu_1604_changes stable
Name Size Rev Age Author Last Change
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basis 47b463   8 years FrederikHeber Added all crashing tests to XFAIL. - note that they also crash in the …
cints bbc982   8 years FrederikHeber Various fixes to mpqc_open's configure.ac. - using …
dft 47b463   8 years FrederikHeber Added all crashing tests to XFAIL. - note that they also crash in the …
intcca bbc982   8 years FrederikHeber Various fixes to mpqc_open's configure.ac. - using …
intv3 72461c   8 years FrederikHeber SRCDIR is now added to CPPFLAGS of tests that need it, added .in file …
mbpt 47b463   8 years FrederikHeber Added all crashing tests to XFAIL. - note that they also crash in the …
mbptr12 72461c   8 years FrederikHeber SRCDIR is now added to CPPFLAGS of tests that need it, added .in file …
oint3 251420   8 years FrederikHeber Fixed all src/lib's Makefile.am's linking.
psi 47b463   8 years FrederikHeber Added all crashing tests to XFAIL. - note that they also crash in the …
scf 72461c   8 years FrederikHeber SRCDIR is now added to CPPFLAGS of tests that need it, added .in file …
wfn 47b463   8 years FrederikHeber Added all crashing tests to XFAIL. - note that they also crash in the …
Makefile 1.6 KB a844d8   55 years (none)
  • Property mode set to 040000
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