Changeset 4464ef

Timestamp:

Mar 2, 2017, 7:40:07 AM (8 years ago)

Author:

Frederik Heber <heber@…>

Branches:

Action_Thermostats, Add_AtomRandomPerturbation, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, Automaking_mpqc_open, AutomationFragmentation_failures, 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_documentation, Enable_parallel_make_install, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, FitPartialCharges_GlobalError, Fix_ChronosMutex, 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_IntegrationTest, 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, StoppableMakroAction, Subpackage_levmar, Subpackage_vmg, ThirdParty_MPQC_rebuilt_buildsystem, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps, Ubuntu_1604_changes, stable

Children:

b0af1d

Parents:

73feb7

git-author:

Frederik Heber <heber@…> (12/07/16 19:34:19)

git-committer:

Frederik Heber <heber@…> (03/02/17 07:40:07)

Message:

Added Examples tests that integrate the full fragment automation pipeline.

Files:

• Makefile.am (modified) (1 diff)
• configure.ac (modified) (1 diff)
• tests/Examples/Makefile.am (added)
• tests/Examples/Simple/pre/water.pdb (added)
• tests/Examples/Simple/testsuite-examples-simple-h2o.at (added)
• tests/Examples/testsuite-examples.at (added)
• tests/Examples/testsuite.at (added)
• tests/Makefile.am (modified) (2 diffs)

Makefile.am

@@ -45 +45 @@
 installextracheck:
         cd tests && $(MAKE) installextracheck
+examples:
+        cd tests && $(MAKE) examples 
 
 unity:

configure.ac

@@ -550 +550 @@
 AC_CONFIG_FILES([tests/Tesselations/trianglematcher], [chmod +x tests/Tesselations/trianglematcher])
 
+AC_CONFIG_TESTDIR(tests/Examples)
+AC_CONFIG_FILES([
+        tests/Examples/atlocal 
+        tests/Examples/Makefile])
+AC_CONFIG_FILES([tests/Examples/molecuilder], [chmod +x tests/Examples/molecuilder])
+
 AC_CONFIG_FILES([
         doc/molecuilder.xml])

tests/Makefile.am

@@ -4 +4 @@
         Calculations \
         CodeChecks \
+        Examples \
         GuiChecks \
         regression \
@@ -19 +20 @@
 installextracheck:
         cd Calculations && $(MAKE) installextracheck
+
+examples:
+        cd Examples && $(MAKE) examples