ambit2.smarts

Class StereoChange

java.lang.Object

ambit2.smarts.StereoChange

public class StereoChange
extends Object

Nested Class Summary

Nested Classes

Modifier and Type	Class and Description
static class	StereoChange.StereoElementType

Field Summary

Fields

Modifier and Type	Field and Description
List<org.openscience.cdk.interfaces.IBond>	addLigands0
List<org.openscience.cdk.interfaces.IBond>	addLigands1
List<org.openscience.cdk.interfaces.IAtom>	addLigandsAtoms
StereoChange.StereoElementType	elementType
boolean	ligand0Deleted
boolean	ligand1Deleted
boolean	ligandAtomDeleted

Constructor Summary

Constructors

Constructor and Description
StereoChange()

Method Summary

Modifier and Type	Method and Description
boolean	isValidStereoElement()
void	setStereoElementType(org.openscience.cdk.interfaces.IStereoElement element)
String	toString(org.openscience.cdk.interfaces.IAtomContainer target)

Methods inherited from class java.lang.Object

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

Field Detail

elementType

public StereoChange.StereoElementType elementType

addLigandsAtoms

public List<org.openscience.cdk.interfaces.IAtom> addLigandsAtoms

ligandAtomDeleted

public boolean ligandAtomDeleted

addLigands0

public List<org.openscience.cdk.interfaces.IBond> addLigands0

addLigands1

public List<org.openscience.cdk.interfaces.IBond> addLigands1

ligand0Deleted

public boolean ligand0Deleted

ligand1Deleted

public boolean ligand1Deleted

Constructor Detail

StereoChange

public StereoChange()

Method Detail

setStereoElementType

public void setStereoElementType(org.openscience.cdk.interfaces.IStereoElement element)

isValidStereoElement

public boolean isValidStereoElement()

toString

public String toString(org.openscience.cdk.interfaces.IAtomContainer target)