
org.openscience.cdk.tools.IDeduceBondOrderTool Maven / Gradle / Ivy
/* Copyright (C) 2006-2007 Egon Willighagen
*
* Contact: [email protected]
*
* 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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