Package ffx.potential.nonbonded.octree

Class OctreeParticle

java.lang.Object

ffx.potential.nonbonded.octree.OctreePoint

ffx.potential.nonbonded.octree.OctreeParticle

public class OctreeParticle
extends OctreePoint

OctreeParticle: Object class for Octree method presented in the Fast Multipole Method (FMM) tutorial from the Barba Group: https://github.com/barbagroup/FMM_tutorial

Constructor Summary

Constructors

Constructor	Description
OctreeParticle(double[] coords, double domain, double q)

Method Summary

Modifier and Type	Method	Description
void	addToPhi(double phi)
double	getCharge()
void	setCharge(double q)
void	setDomain(double domain)

Methods inherited from class ffx.potential.nonbonded.octree.OctreePoint

distance, distance, getX, getY, getZ

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Constructor Details

OctreeParticle

public OctreeParticle(double[] coords,
 double domain,
 double q)

Method Details

addToPhi

public void addToPhi(double phi)

getCharge

public double getCharge()

setCharge

public void setCharge(double q)

setDomain

public void setDomain(double domain)

Overrides:

setDomain in class OctreePoint