source: tests/regression/Bond/SetDegree/pre/.pdb@ 2eded3e

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
Last change on this file since 2eded3e was 2d1280, checked in by Frederik Heber <heber@…>, 8 years ago

Added BondSetDegreeAction for manipulating bond degrees.
  • Property mode set to 100644
File size: 237 bytes
RevLine 
[2d1280]1REMARK created by molecuilder on Sat Oct 1 19:45:11 2016, time step 0
2ATOM 1 C01 0tes 01 5.000 5.000 5.000 0.00 0.00 C 0
3ATOM 2 C02 0tes 01 5.000 5.000 6.400 0.00 0.00 C 0
4END
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