Changeset 3dadd5 for tests


Ignore:
Timestamp:
Sep 14, 2016, 1:36:04 PM (8 years ago)
Author:
Frederik Heber <heber@…>
Branches:
Action_Thermostats, Add_AtomRandomPerturbation, Add_FitFragmentPartialChargesAction, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, Automaking_mpqc_open, AutomationFragmentation_failures, Candidate_v1.5.4, 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, EmpiricalPotential_contain_HomologyGraph_documentation, Enable_parallel_make_install, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, FitPartialCharges_GlobalError, Fix_ChargeSampling_PBC, Fix_ChronosMutex, Fix_FitPartialCharges, Fix_FitPotential_needs_atomicnumbers, Fix_ForceAnnealing, Fix_IndependentFragmentGrids, Fix_ParseParticles, Fix_ParseParticles_split_forward_backward_Actions, 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, IndependentFragmentGrids_IndividualZeroInstances, IndependentFragmentGrids_IntegrationTest, IndependentFragmentGrids_Sole_NN_Calculation, 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, SaturateAtoms_findBestMatching, StoppableMakroAction, Subpackage_CodePatterns, Subpackage_JobMarket, Subpackage_LinearAlgebra, Subpackage_levmar, Subpackage_mpqc_open, Subpackage_vmg, ThirdParty_MPQC_rebuilt_buildsystem, TrajectoryDependenant_MaxOrder, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps, Ubuntu_1604_changes, stable
Children:
c4abf2
Parents:
1af2ae
git-author:
Frederik Heber <heber@…> (05/10/16 21:23:50)
git-committer:
Frederik Heber <heber@…> (09/14/16 13:36:04)
Message:

Revert "Removing SphericalPointDistribution::getSimplePolygon() to allow for easy rebasing of very old branch on top."

This reverts commit c8fd68b29755db45c6c61c8b73eba4c88480c5bf.

Conflicts:

src/Fragmentation/Exporters/SphericalPointDistribution.cpp
src/Fragmentation/Exporters/SphericalPointDistribution.hpp

  • needed to reattach SphericalPointDistribution::getSimplifiedPolygon() that was removed in order to ease rebasing a very old branch on top.
  • SaturateAction changed to use WeightedPolygon_t and getRemainingPoints().
Location:
tests/regression/Atoms/Saturate
Files:
2 edited

Legend:

Unmodified
Added
Removed

  • tests/regression/Atoms/Saturate/testsuite-atoms-saturate_carbon.at

    r1af2ae r3dadd5  
    2020AT_SETUP([Atoms - saturating carbon])
    2121AT_KEYWORDS([atoms saturate-atoms])
    22 AT_SKIP_IF([/bin/true])
    2322
    2423file=saturated_carbon.xyz
    … …  
    3029AT_SETUP([Atoms - saturating carbon with Undo])
    3130AT_KEYWORDS([atoms saturate-atoms undo])
    32 AT_SKIP_IF([/bin/true])
    3331
    3432file=carbon.xyz
    … …  
    4038AT_SETUP([Atoms - saturating carbon with Redo])
    4139AT_KEYWORDS([atoms saturate-atoms redo])
    42 AT_SKIP_IF([/bin/true])
    4340
    4441file=saturated_carbon.xyz

  • tests/regression/Atoms/Saturate/testsuite-atoms-saturate_nitrogen.at

    r1af2ae r3dadd5  
    2020AT_SETUP([Atoms - saturating nitrogen])
    2121AT_KEYWORDS([atoms saturate-atoms])
    22 AT_SKIP_IF([/bin/true])
    2322
    2423file=saturated_nitrogen.xyz
    … …  
    3029AT_SETUP([Atoms - saturating nitrogen with Undo])
    3130AT_KEYWORDS([atoms saturate-atoms undo])
    32 AT_SKIP_IF([/bin/true])
    3331
    3432file=nitrogen.xyz
    … …  
    4038AT_SETUP([Atoms - saturating nitrogen with Redo])
    4139AT_KEYWORDS([atoms saturate-atoms redo])
    42 AT_SKIP_IF([/bin/true])
    4340
    4441file=saturated_nitrogen.xyz
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