/*
* 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());
}
}
}