org.jmol.smiles
Class SmilesMeasure

java.lang.Object
  org.jmol.smiles.SmilesMeasure

public class SmilesMeasure
extends Object

Field Summary

(package private) int	index
private int[]	indices
(package private) boolean	isNot
private float	max
private float	min
(package private) int	nPoints
private Point3f[]	points
private static float	radiansPerDegree
(package private) SmilesSearch	search
(package private) int	type
(package private) static String	TYPES

Constructor Summary

SmilesMeasure(SmilesSearch search, int index, int type, float min, float max, boolean isNot)

Method Summary

(package private) boolean	addPoint(int index)
(package private) boolean	check()
static void	setTorsionData(Point3f pt1a, Point3f pt1, Point3f pt2, Point3f pt2a, SmilesSearch.VTemp v, boolean isAll)
String	toString()

Methods inherited from class java.lang.Object

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

Field Detail

search

SmilesSearch search

nPoints

int nPoints

type

int type

index

int index

isNot

boolean isNot

indices

private int[] indices

TYPES

static final String TYPES

See Also:

Constant Field Values

min

private float min

max

private float max

radiansPerDegree

private static final float radiansPerDegree

See Also:

Constant Field Values

points

private final Point3f[] points

Constructor Detail

SmilesMeasure

SmilesMeasure(SmilesSearch search,
              int index,
              int type,
              float min,
              float max,
              boolean isNot)

Method Detail

toString

public String toString()

Overrides:

toString in class Object

addPoint

boolean addPoint(int index)

check

boolean check()

setTorsionData

public static void setTorsionData(Point3f pt1a,
                                  Point3f pt1,
                                  Point3f pt2,
                                  Point3f pt2a,
                                  SmilesSearch.VTemp v,
                                  boolean isAll)