IDeduceBondOrderTool.java :  » Science » Chemistry-Development-Kit-1.3.5 » org » openscience » cdk » tools » Java Open Source

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Chemistry Development Kit 1.3.5 » org » openscience » cdk » tools » IDeduceBondOrderTool.java
/* $Revision$ $Author$ $Date$
 *
 * 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.
 * All we ask is that proper credit is given for our 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.tools;

import org.openscience.cdk.exception.CDKException;
import org.openscience.cdk.interfaces.IAtomContainer;

/**
 * A common interface for tools that deduce bond orders from connectivity
 * and optionally additional information, like number of implicit or
 * explicit hydrogens, or hybridization states.
 *
 * @author      Egon Willighagen
 * @cdk.created 2006-08-16
 * @cdk.module  valencycheck
 * @cdk.githash
 */
public interface IDeduceBondOrderTool {

  public void saturate(IAtomContainer ac) throws CDKException;

}

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