org.openscience.cdk.geometry

Interface IRDFWeightFunction

public interface IRDFWeightFunction

Weight function used in the RDFCalculator.

Author:

Egon Willighagen

See Also:

RDFCalculator

Source code:

master

Belongs to CDK module:

extra

Created on:

2005-01-14

Method Summary

Methods

Modifier and Type	Method and Description
double	calculate(IAtom atom, IAtom atom2) Calculates the weight for the interaction between the two atoms.

Method Detail

calculate

double calculate(IAtom atom,
               IAtom atom2)

Calculates the weight for the interaction between the two atoms.

Parameters:

atom - First atom.

atom2 - Second atom.