openmmtools.integrators.GeodesicBAOABIntegrator
===============================================

.. currentmodule:: openmmtools.integrators

.. autoclass:: GeodesicBAOABIntegrator

   
   .. automethod:: __init__

   
   .. rubric:: Methods

   .. autosummary::
   
      ~GeodesicBAOABIntegrator.__init__
      ~GeodesicBAOABIntegrator.addComputeGlobal
      ~GeodesicBAOABIntegrator.addComputePerDof
      ~GeodesicBAOABIntegrator.addComputeSum
      ~GeodesicBAOABIntegrator.addComputeTemperatureDependentConstants
      ~GeodesicBAOABIntegrator.addConstrainPositions
      ~GeodesicBAOABIntegrator.addConstrainVelocities
      ~GeodesicBAOABIntegrator.addGlobalVariable
      ~GeodesicBAOABIntegrator.addPerDofVariable
      ~GeodesicBAOABIntegrator.addTabulatedFunction
      ~GeodesicBAOABIntegrator.addUpdateContextState
      ~GeodesicBAOABIntegrator.beginIfBlock
      ~GeodesicBAOABIntegrator.beginWhileBlock
      ~GeodesicBAOABIntegrator.deserialize_xml
      ~GeodesicBAOABIntegrator.endBlock
      ~GeodesicBAOABIntegrator.getComputationStep
      ~GeodesicBAOABIntegrator.getConstraintTolerance
      ~GeodesicBAOABIntegrator.getGlobalVariable
      ~GeodesicBAOABIntegrator.getGlobalVariableByName
      ~GeodesicBAOABIntegrator.getGlobalVariableName
      ~GeodesicBAOABIntegrator.getIntegrationForceGroups
      ~GeodesicBAOABIntegrator.getKineticEnergyExpression
      ~GeodesicBAOABIntegrator.getNumComputations
      ~GeodesicBAOABIntegrator.getNumGlobalVariables
      ~GeodesicBAOABIntegrator.getNumPerDofVariables
      ~GeodesicBAOABIntegrator.getNumTabulatedFunctions
      ~GeodesicBAOABIntegrator.getPerDofVariable
      ~GeodesicBAOABIntegrator.getPerDofVariableByName
      ~GeodesicBAOABIntegrator.getPerDofVariableName
      ~GeodesicBAOABIntegrator.getRandomNumberSeed
      ~GeodesicBAOABIntegrator.getStepSize
      ~GeodesicBAOABIntegrator.getTabulatedFunction
      ~GeodesicBAOABIntegrator.getTabulatedFunctionName
      ~GeodesicBAOABIntegrator.getTemperature
      ~GeodesicBAOABIntegrator.get_acceptance_rate
      ~GeodesicBAOABIntegrator.get_heat
      ~GeodesicBAOABIntegrator.get_shadow_work
      ~GeodesicBAOABIntegrator.is_restorable
      ~GeodesicBAOABIntegrator.is_thermostated
      ~GeodesicBAOABIntegrator.pretty_format
      ~GeodesicBAOABIntegrator.pretty_print
      ~GeodesicBAOABIntegrator.reset
      ~GeodesicBAOABIntegrator.reset_ghmc_statistics
      ~GeodesicBAOABIntegrator.reset_heat
      ~GeodesicBAOABIntegrator.reset_shadow_work
      ~GeodesicBAOABIntegrator.restore_interface
      ~GeodesicBAOABIntegrator.setConstraintTolerance
      ~GeodesicBAOABIntegrator.setGlobalVariable
      ~GeodesicBAOABIntegrator.setGlobalVariableByName
      ~GeodesicBAOABIntegrator.setIntegrationForceGroups
      ~GeodesicBAOABIntegrator.setKineticEnergyExpression
      ~GeodesicBAOABIntegrator.setPerDofVariable
      ~GeodesicBAOABIntegrator.setPerDofVariableByName
      ~GeodesicBAOABIntegrator.setRandomNumberSeed
      ~GeodesicBAOABIntegrator.setStepSize
      ~GeodesicBAOABIntegrator.setTemperature
      ~GeodesicBAOABIntegrator.step
   
   

   
   
   .. rubric:: Attributes

   .. autosummary::
   
      ~GeodesicBAOABIntegrator.BlockEnd
      ~GeodesicBAOABIntegrator.ComputeGlobal
      ~GeodesicBAOABIntegrator.ComputePerDof
      ~GeodesicBAOABIntegrator.ComputeSum
      ~GeodesicBAOABIntegrator.ConstrainPositions
      ~GeodesicBAOABIntegrator.ConstrainVelocities
      ~GeodesicBAOABIntegrator.IfBlockStart
      ~GeodesicBAOABIntegrator.UpdateContextState
      ~GeodesicBAOABIntegrator.WhileBlockStart
      ~GeodesicBAOABIntegrator.acceptance_rate
      ~GeodesicBAOABIntegrator.global_variable_names
      ~GeodesicBAOABIntegrator.heat
      ~GeodesicBAOABIntegrator.is_metropolized
      ~GeodesicBAOABIntegrator.kT
      ~GeodesicBAOABIntegrator.shadow_work
      ~GeodesicBAOABIntegrator.thisown