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/*
*
* Licensed to the Apache Software Foundation (ASF) under one
* or more contributor license agreements. See the NOTICE file
* distributed with this work for additional information
* regarding copyright ownership. The ASF licenses this file
* to you under the Apache License, Version 2.0 (the
* "License"); you may not use this file except in compliance
* with the License. You may obtain a copy of the License at
*
* http://www.apache.org/licenses/LICENSE-2.0
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* Unless required by applicable law or agreed to in writing,
* software distributed under the License is distributed on an
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* KIND, either express or implied. See the License for the
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package org.apche.airavata.datacat.parsers.gridchem.inchi;
import junit.framework.Assert;
import org.apache.airavata.datacat.parsers.gridchem.inchi.InChI;
import org.apache.airavata.datacat.parsers.gridchem.inchi.InChIGenerator;
import org.apache.airavata.datacat.parsers.gridchem.util.Constants;
import org.apache.airavata.datacat.parsers.gridchem.util.GridChemProperties;
import org.apache.commons.io.FileUtils;
import org.apache.log4j.Logger;
import org.apche.airavata.datacat.parsers.gridchem.AbstractGridChemParserTest;
import org.junit.Before;
import org.junit.Test;
import java.io.File;
import java.io.IOException;
import java.util.UUID;
public class InChIGeneratorGridChemParserTest extends AbstractGridChemParserTest {
private Logger logger = Logger.getLogger(InChIGeneratorGridChemParserTest.class);
@Before
public void setUp() {
super.setUp();
}
@Test
public void testGetInChI() throws Exception {
try {
String uniqueID = UUID.randomUUID().toString();
File source = new File(TEST_OUTPUT);
File dest = new File(GridChemProperties.getInstance().getProperty(
Constants.TMP_DIR,"") + "/" + uniqueID + ".out");
FileUtils.copyFile(source, dest);
InChIGenerator inChIGenerator = new InChIGenerator(uniqueID);
InChI inChI = inChIGenerator.getInChI();
logger.info("TEST MESSAGE");
logger.info(inChI.getInchi() + " inchi key: " + inChI.getInchiKey());
Assert.assertNotNull(inChI.getInchi());
Assert.assertNotNull(inChI.getInchiKey());
} catch (IOException ignore) {
ignore.printStackTrace();
}
}
}