/* $RCSfile$ * $Author$ * $Date$ * $Revision$ * * Copyright (C) 2004-2007 The Chemistry Development Kit (CDK) project * * Contact: cdk-devel@lists.sourceforge.net * * This program is free software; you can redistribute it and/or * modify it under the terms of the GNU Lesser General Public License * as published by the Free Software Foundation; either version 2.1 * of the License, or (at your option) any later version. * * This program is distributed in the hope that it will be useful, * but WITHOUT ANY WARRANTY; without even the implied warranty of * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the * GNU Lesser General Public License for more details. * * You should have received a copy of the GNU Lesser General Public License * along with this program; if not, write to the Free Software * Foundation, Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 USA. */ package org.openscience.cdk.isomorphism.matchers.smarts; import org.openscience.cdk.interfaces.IAtom; /** * This matches an atom with chirality property. It is not implemented yet. * It'll match any atom right now. * * @cdk.module smarts * @cdk.githash * @cdk.keyword SMARTS */ public class ChiralityAtom extends SMARTSAtom { /** * The degree of the chirality */ private int degree; /** * Whether unspecified chirality should be taken into consideration */ private boolean unspecified; /** * Whether the chirality is clockwise */ private boolean clockwise; public int getDegree() { return degree; } public void setDegree(int degree) { this.degree = degree; } public boolean isUnspecified() { return unspecified; } public void setUnspecified(boolean unspecified) { this.unspecified = unspecified; } public boolean isClockwise() { return clockwise; } public void setClockwise(boolean clockwise) { this.clockwise = clockwise; } /** * Creates a new instance * */ public ChiralityAtom() { super(); } public boolean matches(IAtom atom) { // TODO: Chirality matching logic return true; } }