AtomHydrophobicityCalculator.hpp File Reference

Definition of the class CDPL::MolProp::AtomHydrophobicityCalculator. More...

#include <string>
#include <vector>
#include "CDPL/MolProp/APIPrefix.hpp"
#include "CDPL/Chem/Fragment.hpp"
#include "CDPL/Util/Array.hpp"

Go to the source code of this file.

Classes
class	CDPL::MolProp::AtomHydrophobicityCalculator
	Implements Greene's algorithm [CATA] for the calculation of atom hydrophobicities. More...

Namespaces
	CDPL
	The namespace of the Chemical Data Processing Library.
	CDPL::MolProp
	Contains classes and functions related to the calculation/preciction of physicochemical molecular properties.

Detailed Description

Definition of the class CDPL::MolProp::AtomHydrophobicityCalculator.