Changeset 7a1dd0 for tests/regression/Parser
- Timestamp:
- Apr 18, 2011, 3:00:06 PM (14 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:
- b404da
- Parents:
- 4fdc65
- git-author:
- Frederik Heber <heber@…> (04/18/11 10:05:27)
- git-committer:
- Frederik Heber <heber@…> (04/18/11 15:00:06)
- Location:
- tests/regression/Parser
- Files:
-
- 5 added
- 5 edited
Legend:
- Unmodified
- Added
- Removed
-
tests/regression/Parser/Mpqc/testsuite-parser-mpqc.at
r4fdc65 r7a1dd0 1 1 ### parsing mpqc 2 3 AT_SETUP([Parser - loading empty mpqc file]) 4 AT_KEYWORDS([parser,mpqc,emptyfile]) 5 AT_CHECK([/bin/cp ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Mpqc/pre/empty.in .], 0, [ignore], [ignore]) 6 AT_CHECK([../../molecuilder -i empty.in -o mpqc], 0, [ignore], [ignore]) 7 AT_CLEANUP 2 8 3 9 AT_SETUP([Parser - loading mpqc file]) -
tests/regression/Parser/Pcp/testsuite-parser-pcp.at
r4fdc65 r7a1dd0 1 1 ### parsing pcp 2 3 AT_SETUP([Parser - loading empty conf file]) 4 AT_KEYWORDS([parser,pcp,emptyfile]) 5 AT_CHECK([/bin/cp ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Pcp/pre/empty.conf .], 0, [ignore], [ignore]) 6 AT_CHECK([../../molecuilder -i empty.conf -o pcp], 0, [ignore], [ignore]) 7 AT_CLEANUP 2 8 3 9 AT_SETUP([Parser - loading conf file]) -
tests/regression/Parser/Pdb/testsuite-parser-pdb.at
r4fdc65 r7a1dd0 1 1 ### parsing pdb 2 3 AT_SETUP([Parser - loading empty pdb file]) 4 AT_KEYWORDS([parser,pdb,emptyfile]) 5 AT_CHECK([echo "" >test.pdb], 0, [ignore], [ignore]) 6 AT_CHECK([../../molecuilder -i test.pdb -o pdb], 0, [ignore], [ignore]) 7 AT_CLEANUP 2 8 3 9 AT_SETUP([Parser - loading pdb file]) -
tests/regression/Parser/Tremolo/testsuite-parser-tremolo.at
r4fdc65 r7a1dd0 1 1 ### parsing tremolo 2 3 AT_SETUP([Parser - loading empty tremolo file]) 4 AT_KEYWORDS([parser,tremolo,emptyfile]) 5 AT_CHECK([/bin/cp ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Tremolo/pre/empty.data .], 0, [ignore], [ignore]) 6 AT_CHECK([../../molecuilder -i empty.data -o tremolo], 0, [ignore], [ignore]) 7 AT_CLEANUP 2 8 3 9 AT_SETUP([Parser - loading tremolo file]) -
tests/regression/Parser/Xyz/testsuite-parser-xyz.at
r4fdc65 r7a1dd0 1 1 ### parsing xyz 2 3 AT_SETUP([Parser - loading empty xyz file]) 4 AT_KEYWORDS([parser,xyz,emptyfile]) 5 AT_CHECK([/bin/cp ${abs_top_srcdir}/${AUTOTEST_PATH}/Parser/Xyz/pre/empty.xyz .], 0, [ignore], [ignore]) 6 AT_CHECK([../../molecuilder -i empty.xyz -o xyz], 0, [ignore], [ignore]) 7 AT_CLEANUP 2 8 3 9 AT_SETUP([Parser - loading xyz file])
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