demo.DemoCATH Maven / Gradle / Ivy
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The protein structure modules of BioJava.
/*
* 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/
*
*/
package demo;
import org.biojava.nbio.structure.Structure;
import org.biojava.nbio.structure.align.util.AtomCache;
import org.biojava.nbio.structure.cath.CathDatabase;
import org.biojava.nbio.structure.cath.CathDomain;
import org.biojava.nbio.structure.cath.CathInstallation;
/** An example for how to access CATH data.
*
* run with -Xmx512M
*
* @author Andreas Prlic
*
*/
public class DemoCATH {
public static void main(String[] args){
AtomCache cache = new AtomCache();
CathDatabase database = new CathInstallation(cache.getPath());
String domainID = "1cdgA01";
CathDomain cathDomain = database.getDescriptionByCathId(domainID);
System.out.println(cathDomain);
Structure cathDomainStructure;
try {
cathDomainStructure = cache.getStructure(domainID);
System.out.println(cathDomainStructure);
} catch (Exception e) {
// TODO Auto-generated catch block
e.printStackTrace();
}
}
}