/* * $RCSfile$ * $Author$ * $Date$ * $Revision$ * * Copyright (C) 2002-2006 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. * All I ask is that proper credit is given for my work, which includes * - but is not limited to - adding the above copyright notice to the beginning * of your source code files, and to any copyright notice that you may distribute * with programs based on this work. * * 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.CDKConstants; import org.openscience.cdk.interfaces.IAtom; /** * This matcher checks the number of ring connections of the checked Atom with * other Atom's. This cannot be matched with a unpreprocessed Atom! * * @cdk.module smarts * @cdk.githash * @cdk.keyword SMARTS */ public class TotalRingConnectionAtom extends SMARTSAtom { /** * Creates a new instance * * @param ringConn number of ring connections */ public TotalRingConnectionAtom(int ringConn) { this.setProperty(CDKConstants.RING_CONNECTIONS, ringConn); } /** * Returns the ring connection of an atom * * @param atom * @return */ private int getRC(IAtom atom) { if (atom.getFlag(CDKConstants.ISINRING)) return ((Integer) atom.getProperty(CDKConstants.RING_CONNECTIONS)) .intValue(); else return 0; } /* (non-Javadoc) * @see org.openscience.cdk.isomorphism.matchers.smarts.SMARTSAtom#matches(org.openscience.cdk.interfaces.IAtom) */ public boolean matches(IAtom atom) { return getRC(atom) != 0 && getRC(atom) == getRC(this); } /* (non-Javadoc) * @see org.openscience.cdk.PseudoAtom#toString() */ public String toString() { return ("TotalRingConnectionAtom(" + getRC(this) + ")"); } }