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
Docu_Python_wait
EmpiricalPotential_contain_HomologyGraph_documentation
Enhance_userguide
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
Fix_StatusMsg
Fix_StepWorldTime_single_argument
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
QtGui_reactivate_TimeChanged_changes
Recreated_GuiChecks
RotateToPrincipalAxisSystem_UndoRedo
StoppableMakroAction
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
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Last change
on this file since 536b13 was 3a51bd, checked in by Frederik Heber <heber@…>, 12 years ago |
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Added new StretchBondAction to stretch the bond within a molecule.
- also added regression test with undo and redo on this.
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Property mode
set to
100644
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File size:
243 bytes
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| 2 | Created by molecuilder on Wed Sep 26 14:21:04 2012, time step 0
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| 4 | C 11.4411 8.98091 10
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| 5 | H 9.80813 10.765 9.11
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| 6 | H 9.80813 10.765 10.89
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| 7 | H 11.4411 8.35161 9.11
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| 8 | H 11.4411 8.35161 10.89
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| 9 | H 8.91815 9.50637 10
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| 10 | H 12.3312 9.61026 10
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