meshi.energy.solvateRot1
Class SolvateRot1ParametersList

java.lang.Object
  meshi.energy.solvateRot1.SolvateRot1ParametersList

All Implemented Interfaces:

Parameters

public class SolvateRot1ParametersList
extends java.lang.Object
implements Parameters

Field Summary

int[]	atomicTypeConverter
Spline1D[]	atomTypeSplines
double[][]	Cend
double[][]	Cp1
double[][]	Cp2
double[][]	CvalAtp1
double[][]	CvalAtp2
double	maxEnd
int	NTsai

Constructor Summary

SolvateRot1ParametersList(java.lang.String[] parameterFiles)
The parameter to the constructor is an array of 7 Strings, giving the 7 files required as parameters.

Method Summary

Parameters	createParameters(java.lang.String s)
Parameters	parameters(java.lang.Object obj)
private void	readSigmoidValueFile(double[][] ar, java.lang.String filename)

Methods inherited from class java.lang.Object

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

Field Detail

NTsai

public final int NTsai

See Also:

Constant Field Values

atomicTypeConverter

public final int[] atomicTypeConverter

maxEnd

public final double maxEnd

atomTypeSplines

public final Spline1D[] atomTypeSplines

Cend

public final double[][] Cend

Cp1

public final double[][] Cp1

Cp2

public final double[][] Cp2

CvalAtp1

public final double[][] CvalAtp1

CvalAtp2

public final double[][] CvalAtp2

Constructor Detail

SolvateRot1ParametersList

public SolvateRot1ParametersList(java.lang.String[] parameterFiles)

The parameter to the constructor is an array of 7 Strings, giving the 7 files required as parameters. See the MeshiPotential class for a detailed list.

Method Detail

createParameters

public Parameters createParameters(java.lang.String s)

parameters

public Parameters parameters(java.lang.Object obj)

readSigmoidValueFile

private void readSigmoidValueFile(double[][] ar,
                                  java.lang.String filename)