Ignore:
Timestamp:
Dec 16, 2009, 4:17:50 PM (15 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:
0b2dd2
Parents:
e359a8
git-author:
Frederik Heber <heber@…> (12/16/09 16:13:53)
git-committer:
Frederik Heber <heber@…> (12/16/09 16:17:50)
Message:

Fixing the testsuite.

  • Putting performCriticalExit() everywhere blindly, is not actually such a good idea. Sometimes, we try opening files but it its not really bad when it fails. As there are fallbacks:

Signed-off-by: Frederik Heber <heber@…>

Location:
tests/regression/Tesselation/2/post
Files:
4 edited

Legend:

Unmodified
Added
Removed

  • tests/regression/Tesselation/2/post/ConvexEnvelope.dat

    re359a8 r482373  
    11TITLE = "3D CONVEX SHELL"
    22VARIABLES = "X" "Y" "Z" "U"
    3 ZONE T="0- H08_ H09_ H11", N=8, E=12, DATAPACKING=POINT, ZONETYPE=FETRIANGLE
     3ZONE T="test", N=8, E=12, DATAPACKING=POINT, ZONETYPE=FETRIANGLE
    449.78209 2.64589 2.64589 0
    559.78209 2.64589 4.42589 0
    … …  
    13131 3 4
    14141 4 7
     154 6 7
    15163 4 5
    16 1 7 8
    17 1 2 8
    18 4 6 7
     174 5 6
    19182 3 5
    20 4 5 6
    21 6 7 8
    22 1 2 3
    23192 5 8
    24205 6 8
     216 7 8
     221 2 7
     232 7 8
     241 2 3

  • tests/regression/Tesselation/2/post/ConvexEnvelope.r3d

    re359a8 r482373  
    3434  1.37419 -0.89433 -0.89        0.12489 1.24767 -0.89   -1.12431 -0.89433 -0.89         1. 0. 0.
    35351
    36   2.26414 0.364321 -4.44089e-16         0.12489 1.24767 -0.89   0.12489 1.24767 0.89    1. 0. 0.
    37 1
    38   1.37419 -0.89433 -0.89        -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
    39 1
    40   1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   -1.12431 -0.89433 0.89  1. 0. 0.
    41 1
    4236  0.12489 1.24767 -0.89         -2.01426 0.364321 -4.44089e-16  -1.12431 -0.89433 -0.89         1. 0. 0.
    43371
    44   1.37419 -0.89433 0.89         2.26414 0.364321 -4.44089e-16   0.12489 1.24767 0.89    1. 0. 0.
     38  2.26414 0.364321 -4.44089e-16         0.12489 1.24767 -0.89   0.12489 1.24767 0.89    1. 0. 0.
    45391
    4640  0.12489 1.24767 -0.89         0.12489 1.24767 0.89    -2.01426 0.364321 -4.44089e-16  1. 0. 0.
    47411
    48   -2.01426 0.364321 -4.44089e-16        -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
    49 1
    50   1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   2.26414 0.364321 -4.44089e-16   1. 0. 0.
     42  1.37419 -0.89433 0.89         2.26414 0.364321 -4.44089e-16   0.12489 1.24767 0.89    1. 0. 0.
    51431
    5244  1.37419 -0.89433 0.89         0.12489 1.24767 0.89    -1.12431 -0.89433 0.89  1. 0. 0.
    53451
    5446  0.12489 1.24767 0.89  -2.01426 0.364321 -4.44089e-16  -1.12431 -0.89433 0.89  1. 0. 0.
     471
     48  -2.01426 0.364321 -4.44089e-16        -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
     491
     50  1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   -1.12431 -0.89433 -0.89         1. 0. 0.
     511
     52  1.37419 -0.89433 0.89         -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
     531
     54  1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   2.26414 0.364321 -4.44089e-16   1. 0. 0.
    55559
    5656#  terminating special property
    … …  
    5959  25.0    0.6     -1.0 -1.0 -1.0     0.2        0 0 0 0
    60602
    61   -1.00456 0.23922 0.593333     5       1 0 0
     61  1.67084 -0.47478 -8.88178e-16 5       1 0 0
    62629
    6363  terminating special property

  • tests/regression/Tesselation/2/post/NonConvexEnvelope.dat

    re359a8 r482373  
    11TITLE = "3D CONVEX SHELL"
    22VARIABLES = "X" "Y" "Z" "U"
    3 ZONE T="0- H08_ H09_ H11", N=8, E=12, DATAPACKING=POINT, ZONETYPE=FETRIANGLE
     3ZONE T="test", N=8, E=12, DATAPACKING=POINT, ZONETYPE=FETRIANGLE
    449.78209 2.64589 2.64589 0
    559.78209 2.64589 4.42589 0
    … …  
    13131 3 4
    14141 4 7
     154 6 7
    15163 4 5
    16 1 7 8
    17 1 2 8
    18 4 6 7
     174 5 6
    19182 3 5
    20 4 5 6
    21 6 7 8
    22 1 2 3
    23192 5 8
    24205 6 8
     216 7 8
     221 2 7
     232 7 8
     241 2 3

  • tests/regression/Tesselation/2/post/NonConvexEnvelope.r3d

    re359a8 r482373  
    3434  1.37419 -0.89433 -0.89        0.12489 1.24767 -0.89   -1.12431 -0.89433 -0.89         1. 0. 0.
    35351
    36   2.26414 0.364321 -4.44089e-16         0.12489 1.24767 -0.89   0.12489 1.24767 0.89    1. 0. 0.
    37 1
    38   1.37419 -0.89433 -0.89        -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
    39 1
    40   1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   -1.12431 -0.89433 0.89  1. 0. 0.
    41 1
    4236  0.12489 1.24767 -0.89         -2.01426 0.364321 -4.44089e-16  -1.12431 -0.89433 -0.89         1. 0. 0.
    43371
    44   1.37419 -0.89433 0.89         2.26414 0.364321 -4.44089e-16   0.12489 1.24767 0.89    1. 0. 0.
     38  2.26414 0.364321 -4.44089e-16         0.12489 1.24767 -0.89   0.12489 1.24767 0.89    1. 0. 0.
    45391
    4640  0.12489 1.24767 -0.89         0.12489 1.24767 0.89    -2.01426 0.364321 -4.44089e-16  1. 0. 0.
    47411
    48   -2.01426 0.364321 -4.44089e-16        -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
    49 1
    50   1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   2.26414 0.364321 -4.44089e-16   1. 0. 0.
     42  1.37419 -0.89433 0.89         2.26414 0.364321 -4.44089e-16   0.12489 1.24767 0.89    1. 0. 0.
    51431
    5244  1.37419 -0.89433 0.89         0.12489 1.24767 0.89    -1.12431 -0.89433 0.89  1. 0. 0.
    53451
    5446  0.12489 1.24767 0.89  -2.01426 0.364321 -4.44089e-16  -1.12431 -0.89433 0.89  1. 0. 0.
     471
     48  -2.01426 0.364321 -4.44089e-16        -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
     491
     50  1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   -1.12431 -0.89433 -0.89         1. 0. 0.
     511
     52  1.37419 -0.89433 0.89         -1.12431 -0.89433 -0.89         -1.12431 -0.89433 0.89  1. 0. 0.
     531
     54  1.37419 -0.89433 -0.89        1.37419 -0.89433 0.89   2.26414 0.364321 -4.44089e-16   1. 0. 0.
    55559
    5656#  terminating special property
    … …  
    5959  25.0    0.6     -1.0 -1.0 -1.0     0.2        0 0 0 0
    60602
    61   -1.00456 0.23922 0.593333     5       1 0 0
     61  1.67084 -0.47478 -8.88178e-16 5       1 0 0
    62629
    6363  terminating special property
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