mailr21492 - /trunk/lib/structure/mass.py


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Posted by edward on November 17, 2013 - 20:39:
Author: bugman
Date: Sun Nov 17 20:39:27 2013
New Revision: 21492

URL: http://svn.gna.org/viewcvs/relax?rev=21492&view=rev
Log:
Bug fix for the lib.structure.mass.centre_of_mass() function warning when the 
element is not known.

This warning was buggy and resulted tracebacks.


Modified:
    trunk/lib/structure/mass.py

Modified: trunk/lib/structure/mass.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/lib/structure/mass.py?rev=21492&r1=21491&r2=21492&view=diff
==============================================================================
--- trunk/lib/structure/mass.py (original)
+++ trunk/lib/structure/mass.py Sun Nov 17 20:39:27 2013
@@ -59,7 +59,7 @@
         try:
             mass = return_atomic_mass(elements[i])
         except RelaxError:
-            warn(RelaxWarning("Skipping the atom '%s' as the element '%s' is 
unknown." % (id, elements[i])))
+            warn(RelaxWarning("Skipping the atom index %s as the element 
'%s' is unknown." % (i, elements[i])))
 
         # Total mass.
         M = M + mass




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