ConfGen/BondFunctions.hpp File Reference

Declaration of functions that operate on Chem::Bond instances. More...

#include "CDPL/ConfGen/APIPrefix.hpp"

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Namespaces
	CDPL
	The namespace of the Chemical Data Processing Library.
	CDPL::Chem
	Contains classes and functions related to chemistry.
	CDPL::ConfGen
	Contains classes and functions related to conformer ensemble generation.

Functions
CDPL_CONFGEN_API bool	CDPL::ConfGen::isFragmentLinkBond (const Chem::Bond &bond, const Chem::MolecularGraph &molgraph)
CDPL_CONFGEN_API bool	CDPL::ConfGen::isRotatableBond (const Chem::Bond &bond, const Chem::MolecularGraph &molgraph, bool het_h_rotors)

Detailed Description

Declaration of functions that operate on Chem::Bond instances.