Changeset 3f6aac for tests/Python/AllActions/options.dat

Timestamp:

Jul 3, 2017, 3:06:31 PM (8 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

Action_Thermostats, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, AutomationFragmentation_failures, Candidate_v1.6.1, ChemicalSpaceEvaluator, EmpiricalPotential_contain_HomologyGraph_documentation, 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, Gui_displays_atomic_force_velocity, IndependentFragmentGrids_IntegrationTest, JobMarket_RobustOnKillsSegFaults, JobMarket_StableWorkerPool, PythonUI_with_named_parameters, Recreated_GuiChecks, StoppableMakroAction, TremoloParser_IncreasedPrecision, TremoloParser_MultipleTimesteps

Children:

8f2f4e

Parents:

9a4772

git-author:

Frederik Heber <frederik.heber@…> (05/12/17 20:09:49)

git-committer:

Frederik Heber <frederik.heber@…> (07/03/17 15:06:31)

Message:

Added (Un)selectAtomByName.

• Descriptor for AtomByName was already present.
• TESTS: also added regression test.

File:

• tests/Python/AllActions/options.dat (modified) (2 diffs)

tests/Python/AllActions/options.dat

@@ -194 +194 @@
 select-atom-by-element  "4"
 select-atom-by-id       "0"
+select-atom-by-name     "H1"
 select-atom-by-order    "1"
 select-atoms-inside-cuboid      "10 10 10"
@@ -254 +255 @@
 unselect-atom-by-element        "4"
 unselect-atom-by-id     "0"
+unselect-atom-by-name   "H1"
 unselect-atom-by-order  "1"
 unselect-atoms-inside-cuboid    "10 10 10"