/* $RCSfile$
* $Author$
* $Date$
* $Revision$
*
* 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;
/**
* An object containig multiple MoleculeSet and
* the other lower level concepts like rings, sequences,
* fragments, etc.
*
* @cdk.module interfaces
* @cdk.githash
*/
public interface IChemModel extends IChemObject {
/**
* Returns the MoleculeSet of this ChemModel.
*
* @return The MoleculeSet of this ChemModel
* @see #setMoleculeSet
*/
public IMoleculeSet getMoleculeSet();
/**
* Sets the MoleculeSet of this ChemModel.
*
* @param setOfMolecules the content of this model
* @see #getMoleculeSet
*/
public void setMoleculeSet(IMoleculeSet setOfMolecules);
/**
* Returns the RingSet of this ChemModel.
*
* @return the ringset of this model
* @see #setRingSet
*/
public IRingSet getRingSet();
/**
* Sets the RingSet of this ChemModel.
*
* @param ringSet the content of this model
* @see #getRingSet
*/
public void setRingSet(IRingSet ringSet);
/**
* Gets the Crystal contained in this ChemModel.
*
* @return The crystal in this model
* @see #setCrystal
*/
public ICrystal getCrystal();
/**
* Sets the Crystal contained in this ChemModel.
*
* @param crystal the Crystal to store in this model
* @see #getCrystal
*/
public void setCrystal(ICrystal crystal);
/**
* Gets the ReactionSet contained in this ChemModel.
*
* @return The ReactionSet in this model
* @see #setReactionSet
*/
public IReactionSet getReactionSet();
/**
* Sets the ReactionSet contained in this ChemModel.
*
* @param sor the ReactionSet to store in this model
* @see #getReactionSet
*/
public void setReactionSet(IReactionSet sor);
}