Changeset c8446c for tests/regression


Ignore:
Timestamp:
Jul 6, 2012, 10:18:47 AM (13 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:
103eb8
Parents:
7da5cd
git-author:
Frederik Heber <heber@…> (05/31/12 07:59:07)
git-committer:
Frederik Heber <heber@…> (07/06/12 10:18:47)
Message:

Moved basic Fragmentation/Automation regression tests over to JobMarket.

  • removed scripts that were moved over to JobMarket in tests/regression.
Location:
tests/regression
Files:
2 edited

Legend:

Unmodified
Added
Removed

  • tests/regression/Fragmentation/testsuite-fragmentation.at

    r7da5cd rc8446c  
    1 AT_BANNER([MoleCuilder - Fragmentation and Re-fragmentation test])
     1AT_BANNER([MoleCuilder - fragmentation tests])
    22
    3 # fragment the molecule and check the number of configs
     3# check fragmentation
    44m4_include([Fragmentation/FragmentMolecule/testsuite-fragmentation-fragment-molecule.at])
    55
    66# check whether parsing of BondFragment files and re-rwriting config files is working (exit code is 2 as we don't need to continue wrt to ...OrderAtSite)
    77m4_include([Fragmentation/FragmentMolecule-MaxOrder/testsuite-fragmentation-fragment-molecule-maxorder.at])
    8 
    9 # check whether server shutdown works
    10 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-server-shutdown.at])
    11 
    12 # check whether poolworker may succesfully enroll in pool
    13 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-enrollinpool.at])
    14 
    15 # check whether adding jobs works
    16 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-addingjobs.at])
    17 
    18 # check whether checking state works
    19 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-checkstate.at])
    20 
    21 # check whether getting results works
    22 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-getresults.at])
    23 
    24 # check whether Server/Client construct for automatized calculation is working
    25 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-server-worker.at])
    26 
    27 # check whether complete run works
    28 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-completerun.at])
    29 
    30 # check whether resubmitting of failed jobs works
    31 m4_include([Fragmentation/Automation/testsuite-fragmentation-automation-resubmitjobs.at])
    328
    339# check whether stand-in mpqc program works

  • tests/regression/Makefile.am

    r7da5cd rc8446c  
    7575        $(srcdir)/Filling/SuspendInWater/testsuite-suspend-in-water.at \
    7676        $(srcdir)/Fragmentation/testsuite-fragmentation.at \
    77         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-addingjobs.at \
    78         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-checkstate.at \
    79         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-completerun.at \
    80         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-enrollinpool.at \
    81         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-getresults.at \
    8277        $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-mpqc-jobs.at \
    83         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-resubmitjobs.at \
    84         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-server-shutdown.at \
    85         $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-server-worker.at \
    8678        $(srcdir)/Fragmentation/Automation/testsuite-fragmentation-automation-stand-in-mpqc.at \
    8779        $(srcdir)/Fragmentation/FragmentMolecule/testsuite-fragmentation-fragment-molecule.at \
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