From: gmungoc Date: Fri, 20 Feb 2015 17:22:19 +0000 (+0000) Subject: JAL-1673 additional test (and trim of PDB resnum value) X-Git-Url: http://source.jalview.org/gitweb/?p=jalview.git;a=commitdiff_plain;h=23b069c557f7faa1b4ef51b13b00fe99bb2de816 JAL-1673 additional test (and trim of PDB resnum value) --- diff --git a/src/MCview/Atom.java b/src/MCview/Atom.java index 9254fd8..fdca7c2 100755 --- a/src/MCview/Atom.java +++ b/src/MCview/Atom.java @@ -20,7 +20,7 @@ */ package MCview; -import java.awt.*; +import java.awt.Color; public class Atom { @@ -77,16 +77,16 @@ public class Atom chain = str.substring(21, 22); resNumber = Integer.parseInt(str.substring(22, 26).trim()); - resNumIns = str.substring(22, 27); + resNumIns = str.substring(22, 27).trim(); insCode = str.substring(26, 27).charAt(0); - this.x = (float) (new Float(str.substring(30, 38).trim()).floatValue()); - this.y = (float) (new Float(str.substring(38, 46).trim()).floatValue()); - this.z = (float) (new Float(str.substring(47, 55).trim()).floatValue()); + this.x = (new Float(str.substring(30, 38).trim()).floatValue()); + this.y = (new Float(str.substring(38, 46).trim()).floatValue()); + this.z = (new Float(str.substring(47, 55).trim()).floatValue()); // optional entries - see JAL-730 String tm = str.substring(54, 60).trim(); if (tm.length() > 0) { - occupancy = (float) (new Float(tm)).floatValue(); + occupancy = (new Float(tm)).floatValue(); } else { @@ -96,7 +96,7 @@ public class Atom tm = str.substring(60, 66).trim(); if (tm.length() > 0) { - tfactor = (float) (new Float(tm).floatValue()); + tfactor = (new Float(tm).floatValue()); } else { diff --git a/test/jalview/io/AnnotatedPDBFileInputTest.java b/test/jalview/io/AnnotatedPDBFileInputTest.java index 30b6d55..29d5549 100644 --- a/test/jalview/io/AnnotatedPDBFileInputTest.java +++ b/test/jalview/io/AnnotatedPDBFileInputTest.java @@ -7,8 +7,12 @@ import static org.junit.Assert.assertTrue; import jalview.datamodel.AlignmentAnnotation; import jalview.datamodel.AlignmentI; import jalview.datamodel.PDBEntry; +import jalview.datamodel.SequenceFeature; import jalview.datamodel.SequenceI; import jalview.gui.AlignFrame; +import jalview.gui.Desktop; +import jalview.structure.StructureMapping; +import jalview.structure.StructureSelectionManager; import java.io.File; import java.util.Vector; @@ -73,6 +77,48 @@ public class AnnotatedPDBFileInputTest } } + /** + * Check sequence features have been added + */ + @Test + public void checkPDBSequenceFeatures() + { + StructureSelectionManager ssm = StructureSelectionManager + .getStructureSelectionManager(Desktop.instance); + StructureMapping[] mappings = ssm.getMapping("1gaq"); + // suspect we really want to make assertions on sequence features + // in these mappings' sequencess + /* + * 1GAQ/A + */ + SequenceFeature[] sf = al.getSequenceAt(0).getSequenceFeatures(); + assertEquals(296, sf.length); + assertEquals("RESNUM", sf[0].getType()); + assertEquals("GLU:19 1gaqA", sf[0].getDescription()); + assertEquals("RESNUM", sf[295].getType()); + assertEquals("TYR:314 1gaqA", sf[295].getDescription()); + + /* + * 1GAQ/B + */ + sf = al.getSequenceAt(1).getSequenceFeatures(); + assertEquals(98, sf.length); + assertEquals("RESNUM", sf[0].getType()); + assertEquals("ALA:1 1gaqB", sf[0].getDescription()); + assertEquals("RESNUM", sf[97].getType()); + assertEquals("ALA:98 1gaqB", sf[97].getDescription()); + + /* + * 1GAQ/C + */ + sf = al.getSequenceAt(2).getSequenceFeatures(); + assertEquals(296, sf.length); + assertEquals("RESNUM", sf[0].getType()); + assertEquals("GLU:19 1gaqC", sf[0].getDescription()); + assertEquals("RESNUM", sf[295].getType()); + assertEquals("TYR:314 1gaqC", sf[295].getDescription()); + } + @Test public void checkAnnotationWiring() {