/* * BioJava development code * * This code may be freely distributed and modified under the * terms of the GNU Lesser General Public Licence. This should * be distributed with the code. If you do not have a copy, * see: * * http://www.gnu.org/copyleft/lesser.html * * Copyright for this code is held jointly by the individual * authors. These should be listed in @author doc comments. * * For more information on the BioJava project and its aims, * or to join the biojava-l mailing list, visit the home page * at: * * http://www.biojava.org/ * * created at Sep 18, 2013 * Author: ap3 */ package org.biojava.nbio.structure.validation; import org.junit.Test; import javax.xml.bind.JAXBContext; import javax.xml.bind.Unmarshaller; import java.io.InputStream; import java.util.zip.GZIPInputStream; import static org.junit.Assert.fail; public class TestValidationReportParsing { @Test public void test() { String[] testPDBids = new String[]{ "3vtq", "3vtu", "3vtv", "3vtw", "3vu8", "3vua", "3vv5", "3vvd", "3vve", "3vvf", "3vw5", "3w1f", "3w5p", "3w5q", "3w5r", "3w5t", "3w9y", "3wcp", "3zjh", "3zji", "3zjj", "3zjm", "3zjn", "3zjo", "3zjp", "3zjq", "3zjr", "3zjs", "3znv", "3znx", "3znz", "3zoi", "3zoj", "3zpy", }; for (String pdbId : testPDBids){ testPDB(pdbId); } } private void testPDB(String pdbId) { try { JAXBContext ctx = JAXBContext.newInstance(new Class[] {WwPDBValidationInformation.class}); Unmarshaller um = ctx.createUnmarshaller(); InputStream inStream = new GZIPInputStream(this.getClass().getResourceAsStream("/validation/"+pdbId+"-valdata.xml.gz")); WwPDBValidationInformation validationReport = (WwPDBValidationInformation) um.unmarshal(inStream); validationReport.getEntry(); // Entry entry = validationReport.getEntry(); // System.out.println(pdbId + " " + entry.getPDBRevisionNumber() + // "\t Rfree: " + entry.getDCCRfree() + // "\t Clashscore " + entry.getClashscore() + // "\t % Ramachandran outliers: " + entry.getPercentRamaOutliers() + // "\t % RSRC outliers: " + entry.getPercentRSRZOutliers() ); } catch (Exception e){ e.printStackTrace(); fail(e.getMessage()); } } }