r11134 - /branches/bieri_gui/gui_bieri/analyses/auto_noe.py -- April 23, 2010 - 04:32

Author: michaelbieri
Date: Fri Apr 23 04:32:16 2010
New Revision: 11134

URL: http://svn.gna.org/viewcvs/relax?rev=11134&view=rev
Log:
NOE color coded pymol macro will automatically created after calculation.

Modified:
    branches/bieri_gui/gui_bieri/analyses/auto_noe.py

Modified: branches/bieri_gui/gui_bieri/analyses/auto_noe.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/bieri_gui/gui_bieri/analyses/auto_noe.py?rev=11134&r1=11133&r2=11134&view=diff
==============================================================================
--- branches/bieri_gui/gui_bieri/analyses/auto_noe.py (original)
+++ branches/bieri_gui/gui_bieri/analyses/auto_noe.py Fri Apr 23 04:32:16 2010
@@ -39,6 +39,7 @@
 
 # relaxGUI module imports.
 from gui_bieri.analyses.project import open_file
+from gui_bieri.analyses.results_analysis import color_code_noe
 from gui_bieri.base_classes import Container
 from gui_bieri.controller import Redirect_text, Thread_container
 from gui_bieri.derived_wx_classes import StructureTextCtrl
@@ -525,6 +526,15 @@
         # Add noe grace plot to relax data store.
         
ds.relax_gui.results_noe.append(data.save_dir+sep+'grace'+sep+'noe.agr')
 
+        # Create color coded structure pymol macro.
+        color_code_noe(self, data.save_dir, data.structure_file)
+
+        # add macro to results tab
+        self.gui.list_noe.Append(data.save_dir+sep+'noe.pml')
+
+        # Add noe macro to relax data store.
+        ds.relax_gui.results_noe.append(data.save_dir+sep+'noe.pml')
+
 
     def link_data(self, data):
         """Re-alias the storage container in the relax data store.