X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;ds=sidebyside;f=src%2FMCview%2FAtom.java;h=0a3bd3988ed0fdb55b89d5ba64957cfc404d9452;hb=7f700a0a56fa9946b0186bffa34f510777599c66;hp=8b160efddbb8085ccbe27a942596599007053cf2;hpb=153dd62dc91da13ae732600e6ea55ddbe15eab39;p=jalview.git diff --git a/src/MCview/Atom.java b/src/MCview/Atom.java index 8b160ef..0a3bd39 100755 --- a/src/MCview/Atom.java +++ b/src/MCview/Atom.java @@ -50,9 +50,10 @@ public class Atom public int atomIndex; public float occupancy = 0; - + public float tfactor = 0; - + // need these if we ever want to export Atom data + // public boolean tfacset=true,occset=true; public boolean isSelected = false; public Atom(String str) @@ -71,9 +72,22 @@ public class Atom 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()); - occupancy = (float) (new Float(str.substring(54, 60).trim()) - .floatValue()); - tfactor = (float) (new Float(str.substring(60, 66).trim()).floatValue()); + // optional entries - see JAL-730 + String tm = str.substring(54, 60).trim(); + if (tm.length()>0) { + occupancy = (float) (new Float(tm)).floatValue(); + } else { + occupancy = 1f; // default occupancy + // see note above: occset=false; + } + tm = str.substring(60, 66).trim(); + if (tm.length()>0) + { + tfactor = (float) (new Float(tm).floatValue()); + } else { + tfactor = 1f; + //see note above: tfacset=false; + } } public Atom(float x, float y, float z)