mailr7981 - /1.3/specific_fns/model_free/main.py


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Posted by edward on November 12, 2008 - 21:21:
Author: bugman
Date: Wed Nov 12 21:21:39 2008
New Revision: 7981

URL: http://svn.gna.org/viewcvs/relax?rev=7981&view=rev
Log:
Final fix for bug #12591 (https://gna.org/bugs/index.php?12591).

This bug was reported by Chris Brosey (chris dot a dot brosey att vanderbilt 
dot edu).

The problem was that the global_index counter in the model-free model_loop() 
method was supposed to
be incremented at the start of the loop.  The deselected spin skipping code 
was located before this
though, causing the counter to not be incremented!


Modified:
    1.3/specific_fns/model_free/main.py

Modified: 1.3/specific_fns/model_free/main.py
URL: 
http://svn.gna.org/viewcvs/relax/1.3/specific_fns/model_free/main.py?rev=7981&r1=7980&r2=7981&view=diff
==============================================================================
--- 1.3/specific_fns/model_free/main.py (original)
+++ 1.3/specific_fns/model_free/main.py Wed Nov 12 21:21:39 2008
@@ -1740,12 +1740,12 @@
             # Loop over the spins.
             global_index = -1
             for spin in spin_loop():
+                # Increment the global spin index.
+                global_index = global_index + 1
+
                 # Skip deselected spins.
                 if not spin.select:
                     continue
-
-                # Increment the global spin index.
-                global_index = global_index + 1
 
                 # Yield the spin index.
                 yield global_index




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