starfish.chemistry
Class SuperMol

java.lang.Object
  starfish.chemistry.SuperMol

public class SuperMol
extends java.lang.Object

Constructor Summary

SuperMol(java.lang.String molName)

Method Summary

void	cal_super(double[][] x, double[][] y, int n)
java.util.ArrayList<starfish.chemistry.SuperMol.SuperResult>	doSuper(int fixMol, int moveMol, boolean changeCoordinates)

Methods inherited from class java.lang.Object

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

Constructor Detail

SuperMol

public SuperMol(java.lang.String molName)

Method Detail

doSuper

public java.util.ArrayList<starfish.chemistry.SuperMol.SuperResult> doSuper(int fixMol,
                                                                            int moveMol,
                                                                            boolean changeCoordinates)

cal_super

public void cal_super(double[][] x,
                      double[][] y,
                      int n)