RxDock 0.1.0
A fast, versatile, and open-source program for docking ligands to proteins and nucleic acids
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Public Member Functions | Static Public Attributes | List of all members
rxdock::ChromDihedralRefData Class Reference

Public Member Functions

 ChromDihedralRefData (BondPtr spBond, AtomList tetheredAtoms, double stepSize, ChromElement::eMode mode=ChromElement::FREE, double maxDihedral=0.0)
 
double GetStepSize () const
 
ChromElement::eMode GetMode () const
 
double GetMaxDihedral () const
 
double GetModelValue () const
 
void SetModelValue (double dihedralAngle)
 
double GetInitialValue () const
 

Static Public Attributes

static const std::string _CT = "ChromDihedralRefData"
 
The documentation for this class was generated from the following files:
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