Changeset d6d2129
- Timestamp:
- Jun 19, 2017, 8:24:16 AM (8 years ago)
- Branches:
- Action_Thermostats, Add_AtomRandomPerturbation, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.1, ChangeBugEmailaddress, ChemicalSpaceEvaluator, EmpiricalPotential_contain_HomologyGraph_documentation, Enhance_userguide, Enhanced_StructuralOptimization, Enhanced_StructuralOptimization_continued, Example_ManyWaysToTranslateAtom, Exclude_Hydrogens_annealWithBondGraph, Fix_Verbose_Codepatterns, ForceAnnealing_oldresults, 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, PythonUI_with_named_parameters, QtGui_reactivate_TimeChanged_changes, Recreated_GuiChecks, StoppableMakroAction, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps
- Children:
- 6af6470
- Parents:
- b5bdb9
- git-author:
- Frederik Heber <heber@…> (03/31/17 20:54:52)
- git-committer:
- Frederik Heber <frederik.heber@…> (06/19/17 08:24:16)
- Location:
- tests/regression/Options/DryRun
- Files:
-
- 2 edited
Legend:
- Unmodified
- Added
- Removed
-
tests/regression/Options/DryRun/post/session.py
rb5bdb9 rd6d2129 5 5 pyMoleCuilder.AtomAdd("1", "0,0,0") 6 6 pyMoleCuilder.SelectionAllAtoms() 7 pyMoleCuilder.AtomTranslate(" 0,0,0", "0")7 pyMoleCuilder.AtomTranslate("5,5,5", "0") 8 8 pyMoleCuilder.CommandNoDryRun() 9 9 # =========================== Stored Session END =========================== -
tests/regression/Options/DryRun/testsuite-options-dryrun-storesession.at
rb5bdb9 rd6d2129 23 23 # sample session 24 24 file="session.py" 25 AT_CHECK([../../molecuilder --dry-run --input hydrogen.xyz --add-atom 1 --domain-position "0,0,0" --select-all-atoms --translate-atoms "5,5,5" --no-dry-run --store-session $file --session-type python], 0, [ignore], [ignore])25 AT_CHECK([../../molecuilder --dry-run --input hydrogen.xyz --add-atom 1 --domain-position "0,0,0" --select-all-atoms --translate-atoms --position "5,5,5" --no-dry-run --store-session $file --session-type python], 0, [ignore], [ignore]) 26 26 AT_CHECK([test -f $file], 0, [ignore], [ignore]) 27 27 AT_CHECK([diff $file ${abs_top_srcdir}/tests/regression/Options/DryRun/post/$file], 0, [ignore], [ignore])
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