/*******************************************************************************
 * Copyright (c) 2009  Egon Willighagen <egonw@users.sf.net>
 *
 * All rights reserved. This program and the accompanying materials
 * are made available under the terms of the Eclipse Public License v1.0
 * which accompanies this distribution, and is available at
 * http://www.eclipse.org/legal/epl-v10.html
 *
 * Contact: http://www.bioclipse.net/
 ******************************************************************************/
package net.bioclipse.metware.business;

import org.eclipse.core.runtime.IProgressMonitor;

import net.bioclipse.core.PublishedClass;
import net.bioclipse.core.business.BioclipseException;
import net.bioclipse.jobs.IReturner;
import net.bioclipse.managers.business.IBioclipseManager;

@PublishedClass("The Metware manager is used for interacting with a "
		+ "MetWare.org database.")
public interface IMetwareManager extends IBioclipseManager {
	@PublishedMethod(params = "IMolecule mol, boolean overwrite",
	        methodSummary = "saves mol to a file, if previously read from file. "
	                      + "Overwrite determines if existing file shall be overwritten.")
	public void calculateMetfragScore(IReturner returner,
	IProgressMonitor monitor) throws BioclipseException;
}