/* $RCSfile$ * $Author$ * $Date$ * $Revision$ * * Copyright (C) 2006-2007 Egon Willighagen <egonw@users.sf.net> * * 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.interfaces; /** * A LonePair is an orbital primarily located with one Atom, containing * two electrons. * * @cdk.module interfaces * @cdk.githash * * @cdk.keyword orbital * @cdk.keyword lone-pair */ public interface ILonePair extends IElectronContainer { /** * Returns the associated Atom. * * @return the associated Atom. * @see #setAtom */ public IAtom getAtom(); /** * Sets the associated Atom. * * @param atom the Atom this lone pair will be associated with * @see #getAtom */ public void setAtom(IAtom atom); /** * Returns true if the given atom participates in this lone pair. * * @param atom The atom to be tested if it participates in this bond * @return true if this lone pair is associated with the atom */ public boolean contains(IAtom atom); }