Package ffx.potential.parsers

Class ForceFieldFilter

java.lang.Object

ffx.potential.parsers.ForceFieldFilter

public class ForceFieldFilter
extends Object

The ForceFieldFilter Class is used to parse and store molecular mechanics data from keyword/property and parameter (*.PRM) files.

Alternatively, an Apache Commons "Configuration" instance can be parsed.

Since:

1.0

Author:

Michael J. Schnieders

Constructor Summary

Constructors

Constructor	Description
ForceFieldFilter(org.apache.commons.configuration2.CompositeConfiguration properties)	Constructor for ForceFieldFilter.

Method Summary

Modifier and Type	Method	Description
static void	main(String[] args)	Parse a Force Field parameter file and echo the results with slashes.
ForceField	parse()	parse

Methods inherited from class java.lang.Object

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

Constructor Details

ForceFieldFilter

public ForceFieldFilter(org.apache.commons.configuration2.CompositeConfiguration properties)

Constructor for ForceFieldFilter.

Parameters:

properties - a CompositeConfiguration object.

Method Details

main

public static void main(String[] args)

Parse a Force Field parameter file and echo the results with slashes.

Parameters:

args - an array of String objects.

parse

public ForceField parse()

parse

Returns:

a ForceField object.