Changeset ca331c for tests/regression/Parser

Timestamp:

Jun 18, 2012, 10:53:30 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:

345883

Parents:

5b0581

git-author:

Frederik Heber <heber@…> (06/14/12 13:24:13)

git-committer:

Frederik Heber <heber@…> (06/18/12 10:53:30)

Message:

Added Undo/Redo capability to SetTremoloAtomdataAction.

• SetTremoloAtomdataAction may either set/append or reset the AtomData line.
• TremoloParser has new functions getAtomData() and resetAtomData() along with setAtomData(), added unit test function on the triple.
• TEST: Added undo and redo test to Parser/Tremolo-SetAtomData, also new reset test.

Location:

tests/regression/Parser

Files:

• Tremolo-SetAtomdata/post/output.data (added)
• Tremolo-SetAtomdata/post/undo.data (added)
• Tremolo-SetAtomdata/testsuite-parser-tremolo-resetatomdata.at (added)
• Tremolo-SetAtomdata/testsuite-parser-tremolo-setatomdata.at (modified) (2 diffs)
• Tremolo/post/water-neighbors.data (added)
• testsuite-parser.at (modified) (1 diff)

tests/regression/Parser/Tremolo-SetAtomdata/testsuite-parser-tremolo-setatomdata.at ¶

@@ -1 +1 @@
 ### parsing tremolo
 
-AT_SETUP([Parser - set tremolo's atomdata])
+AT_SETUP([Parser - reset tremolo's atomdata])
 AT_KEYWORDS([parser tremolo set-tremolo-atomdata])
 
@@ -8 +8 @@
 AT_CHECK([chmod u+w $file], 0, [ignore], [ignore])
 AT_CHECK([../../molecuilder -i argon.data --set-tremolo-atomdata "type x=3"], 0, [stdout], [ignore])
-AT_CHECK([file=argon.data; diff -I '%.*' $file ${abs_top_srcdir}/tests/regression/Parser/Tremolo-SetAtomdata/post/argon.data], 0, [ignore], [ignore])
+AT_CHECK([diff -I '%.*' $file ${abs_top_srcdir}/tests/regression/Parser/Tremolo-SetAtomdata/post/argon.data], 0, [ignore], [ignore])
 
 AT_CLEANUP
+
+AT_SETUP([Parser - reset tremolo's atomdata with Undo])
+AT_KEYWORDS([parser tremolo set-tremolo-atomdata undo])
+
+file=argon.data
+AT_CHECK([/bin/cp ${abs_top_srcdir}/tests/regression/Parser/Tremolo-SetAtomdata/pre/argon.data $file], 0, [ignore], [ignore])
+AT_CHECK([chmod u+w $file], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilder -i argon.data --set-tremolo-atomdata "type x=3" --undo], 0, [stdout], [ignore])
+AT_CHECK([diff -I '%.*' $file ${abs_top_srcdir}/tests/regression/Parser/Tremolo-SetAtomdata/post/undo.data], 0, [ignore], [ignore])
+
+AT_CLEANUP
+
+AT_SETUP([Parser - reset tremolo's atomdata with Redo])
+AT_KEYWORDS([parser tremolo set-tremolo-atomdata redo])
+
+file=argon.data
+AT_CHECK([/bin/cp ${abs_top_srcdir}/tests/regression/Parser/Tremolo-SetAtomdata/pre/argon.data $file], 0, [ignore], [ignore])
+AT_CHECK([chmod u+w $file], 0, [ignore], [ignore])
+AT_CHECK([../../molecuilder -i argon.data --set-tremolo-atomdata "type x=3" --undo --redo], 0, [stdout], [ignore])
+AT_CHECK([diff -I '%.*' $file ${abs_top_srcdir}/tests/regression/Parser/Tremolo-SetAtomdata/post/argon.data], 0, [ignore], [ignore])
+
+AT_CLEANUP

tests/regression/Parser/testsuite-parser.at ¶

@@ -59 +59 @@
 # setting tremolo's atomdata line
 m4_include([Parser/Tremolo-SetAtomdata/testsuite-parser-tremolo-setatomdata.at])
+m4_include([Parser/Tremolo-SetAtomdata/testsuite-parser-tremolo-resetatomdata.at])
 
 # writing and exttypes file