r23243 - /branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/generate_base.py -- May 19, 2014 - 16:54

Author: bugman
Date: Mon May 19 16:54:19 2014
New Revision: 23243

URL: http://svn.gna.org/viewcvs/relax?rev=23243&view=rev
Log:
Modification of the structure loading part of the CaM frame order data 
generation base script.

The structures are now only loaded if the DIST_PDB flag is set, as they are 
only used for generating
the 3D distribution of structures.  This saves a lot of time and computer 
memory.

Modified:
    
branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/generate_base.py

Modified: 
branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/generate_base.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/generate_base.py?rev=23243&r1=23242&r2=23243&view=diff
==============================================================================
--- 
branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/generate_base.py
        (original)
+++ 
branches/frame_order_cleanup/test_suite/shared_data/frame_order/cam/generate_base.py
        Mon May 19 16:54:19 2014
@@ -196,9 +196,10 @@
         # Printout.
         sys.stdout.write("\n\nRotating %s states:\n\n" % self.N)
 
-        # Load N copies of the original C-domain.
-        for global_index, mode_indices in self._state_loop():
-            self.interpreter.structure.read_pdb('1J7P_1st_NH.pdb', 
dir=self.path, set_mol_name='C-dom', set_model_num=global_index+1)
+        # Load N copies of the original C-domain for the distribution.
+        if self.DIST_PDB:
+            for global_index, mode_indices in self._state_loop():
+                self.interpreter.structure.read_pdb('1J7P_1st_NH.pdb', 
dir=self.path, set_mol_name='C-dom', set_model_num=global_index+1)
 
         # Turn off the relax interpreter echoing to allow the progress meter 
to be shown correctly.
         self.interpreter.off()