chemaxon.struc

Class StereoActivePart

java.lang.Object

chemaxon.struc.StereoActivePart

@PublicAPI
public class StereoActivePart
extends java.lang.Object

Stereo active molecule part with stereo active atom index and its ligands which takes part in the stereo description.

Since:

Marvin 5.6, 31/05/2011

Author:

Andras Volford, Zsuzsanna Szabo, Janos Kendi

Constructor Summary

Constructors

Constructor and Description
StereoActivePart(int stereoActiveIndex, int[] ligandIndexes) Creates a new stereo active part.

Method Summary

Modifier and Type	Method and Description
boolean	equals(java.lang.Object object)
boolean	equalsTo(java.lang.Object o, int[] map)
int[]	getLigands() Get the ligands of the stereo active atom which take part in the stereo description.
int	getStereoActiveAtom() Get the active atom index.
MolAtom	getStereoActiveRef()
int	hashCode()
void	setAtomRefs(chemaxon.calculations.cip.CloneStateMapper mapper)
java.lang.String	toString()

Methods inherited from class java.lang.Object

clone, finalize, getClass, notify, notifyAll, wait, wait, wait

Constructor Detail

StereoActivePart

public StereoActivePart(int stereoActiveIndex,
                        int[] ligandIndexes)

Creates a new stereo active part.

Parameters:

stereoActiveIndex - index of the stereo active atom

ligandIndexes - array of stereo active atom's ligand indexes that take part in the stereo description

Method Detail

getStereoActiveAtom

public int getStereoActiveAtom()

Get the active atom index.

Returns:

active atom index

getLigands

public int[] getLigands()

Get the ligands of the stereo active atom which take part in the stereo description.

Returns:

the ligands

setAtomRefs

public void setAtomRefs(chemaxon.calculations.cip.CloneStateMapper mapper)

getStereoActiveRef

public MolAtom getStereoActiveRef()

equals

public boolean equals(java.lang.Object object)

Overrides:

equals in class java.lang.Object

equalsTo

public boolean equalsTo(java.lang.Object o,
                        int[] map)

toString

public java.lang.String toString()

Overrides:

toString in class java.lang.Object

hashCode

public int hashCode()

Overrides:

hashCode in class java.lang.Object