/*
* Jalview - A Sequence Alignment Editor and Viewer ($$Version-Rel$$)
* Copyright (C) $$Year-Rel$$ The Jalview Authors
*
* This file is part of Jalview.
*
* Jalview is free software: you can redistribute it and/or
* modify it under the terms of the GNU General Public License
* as published by the Free Software Foundation, either version 3
* of the License, or (at your option) any later version.
*
* Jalview is distributed in the hope that it will be useful, but
* WITHOUT ANY WARRANTY; without even the implied warranty
* of MERCHANTABILITY or FITNESS FOR A PARTICULAR
* PURPOSE. See the GNU General Public License for more details.
*
* You should have received a copy of the GNU General Public License
* along with Jalview. If not, see .
* The Jalview Authors are detailed in the 'AUTHORS' file.
*/
package jalview.ext.paradise;
import static org.junit.Assert.assertTrue;
import java.io.BufferedReader;
import java.io.File;
import java.io.Reader;
import java.util.Iterator;
import org.junit.Assert;
import org.junit.Test;
import MCview.PDBfile;
import compbio.util.FileUtil;
import jalview.datamodel.AlignmentI;
import jalview.datamodel.SequenceI;
import jalview.io.FastaFile;
import jalview.io.FormatAdapter;
public class TestAnnotate3D
{
@Test
public void test1GIDbyId() throws Exception
{
// use same ID as standard tests given at
// https://bitbucket.org/fjossinet/pyrna-rest-clients
Iterator ids = Annotate3D.getRNAMLForPDBId("1GID");
assertTrue("Didn't retrieve 1GID by id.", ids != null);
testRNAMLcontent(ids, null);
}
@Test
public void testIdVsContent2GIS() throws Exception
{
Iterator ids = Annotate3D.getRNAMLForPDBId("2GIS");
assertTrue("Didn't retrieve 2GIS by id.", ids != null);
Iterator files = Annotate3D.getRNAMLForPDBFileAsString(FileUtil
.readFileToString(new File("examples/2GIS.pdb")));
assertTrue("Didn't retrieve using examples/2GIS.pdb.", files != null);
int i = 0;
while (ids.hasNext() && files.hasNext())
{
BufferedReader file = new BufferedReader(files.next()), id = new BufferedReader(
ids.next());
String iline, fline;
do
{
iline = id.readLine();
fline = file.readLine();
if (iline != null)
{
System.out.println(iline);
}
if (fline != null)
{
System.out.println(fline);
}
// next assert fails for latest RNAview - because the XMLID entries
// change between file and ID based RNAML generation.
assertTrue(
"Results differ for ID and file upload based retrieval (chain entry "
+ (++i) + ")",
((iline == fline && iline == null) || (iline != null
&& fline != null && iline.equals(fline))));
} while (iline != null);
}
}
/**
* test to demonstrate JAL-1142 - compare sequences in RNAML returned from
* Annotate3d vs those extracted by Jalview from the originl PDB file
*
* @throws Exception
*/
@Test
public void testPDBfileVsRNAML() throws Exception
{
PDBfile pdbf = new PDBfile(true, false, true, "examples/2GIS.pdb",
FormatAdapter.FILE);
Assert.assertTrue(pdbf.isValid());
// Comment - should add new FileParse constructor like new FileParse(Reader
// ..). for direct reading
Iterator readers = Annotate3D
.getRNAMLForPDBFileAsString(FileUtil.readFileToString(new File(
"examples/2GIS.pdb")));
testRNAMLcontent(readers, pdbf);
}
private void testRNAMLcontent(Iterator readers, PDBfile pdbf)
throws Exception
{
StringBuffer sb = new StringBuffer();
int r = 0;
while (readers.hasNext())
{
System.out.println("Testing RNAML input number " + (++r));
BufferedReader br = new BufferedReader(readers.next());
String line;
while ((line = br.readLine()) != null)
{
sb.append(line + "\n");
}
assertTrue("No data returned by Annotate3D", sb.length() > 0);
final String lines = sb.toString();
AlignmentI al = new FormatAdapter().readFile(lines,
FormatAdapter.PASTE, "RNAML");
if (al == null || al.getHeight() == 0)
{
System.out.println(lines);
}
assertTrue("No alignment returned.", al != null);
assertTrue("No sequences in returned alignment.", al.getHeight() > 0);
if (pdbf != null)
{
for (SequenceI sq : al.getSequences())
{
{
SequenceI struseq = null;
String sq_ = new String(sq.getSequence()).toLowerCase();
for (SequenceI _struseq : pdbf.getSeqsAsArray())
{
final String lowerCase = new String(_struseq.getSequence()).toLowerCase();
if (lowerCase.equals(
sq_))
{
struseq = _struseq;
break;
}
}
if (struseq == null)
{
Assert.fail("Couldn't find this sequence in original input:\n"
+ new FastaFile().print(new SequenceI[]
{ sq })
+ "\n\nOriginal input:\n"
+ new FastaFile().print(pdbf.getSeqsAsArray()) + "\n");
}
}
}
}
}
}
}