Chemical Data Processing Library C++ API - Version 1.1.1
Namespaces | Variables
MMFF94ParameterSet.hpp File Reference

Definition of constants in namespace CDPL::ForceField::MMFF94ParameterSet. More...

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Namespaces

 CDPL
 The namespace of the Chemical Data Processing Library.
 
 CDPL::ForceField
 Contains classes and functions related to molecular force fields.
 
 CDPL::ForceField::MMFF94ParameterSet
 Provides flags for the specification of the MMFF94 parameter set to use.
 

Variables

const unsigned int CDPL::ForceField::MMFF94ParameterSet::DYNAMIC = 0
 
const unsigned int CDPL::ForceField::MMFF94ParameterSet::STATIC = 1
 
const unsigned int CDPL::ForceField::MMFF94ParameterSet::STATIC_XOOP = 2
 
const unsigned int CDPL::ForceField::MMFF94ParameterSet::STATIC_RTOR = 3
 
const unsigned int CDPL::ForceField::MMFF94ParameterSet::STATIC_RTOR_XOOP = 4
 

Detailed Description

Definition of constants in namespace CDPL::ForceField::MMFF94ParameterSet.