mailr17148 - /branches/interatomic/generic_fns/bruker.py


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Posted by edward on July 03, 2012 - 09:33:
Author: bugman
Date: Tue Jul  3 09:33:47 2012
New Revision: 17148

URL: http://svn.gna.org/viewcvs/relax?rev=17148&view=rev
Log:
Converted the bruker.read user function to the interatomic data design.


Modified:
    branches/interatomic/generic_fns/bruker.py

Modified: branches/interatomic/generic_fns/bruker.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/interatomic/generic_fns/bruker.py?rev=17148&r1=17147&r2=17148&view=diff
==============================================================================
--- branches/interatomic/generic_fns/bruker.py (original)
+++ branches/interatomic/generic_fns/bruker.py Tue Jul  3 09:33:47 2012
@@ -31,7 +31,7 @@
 from generic_fns import pipes
 from generic_fns import value
 from generic_fns.exp_info import software_select
-from generic_fns.mol_res_spin import exists_mol_res_spin_data, name_spin, 
spin_loop
+from generic_fns.mol_res_spin import exists_mol_res_spin_data, name_spin, 
set_spin_isotope, spin_loop
 from generic_fns.relax_data import pack_data, peak_intensity_type
 from relax_errors import RelaxError
 from relax_io import open_read_file
@@ -180,8 +180,8 @@
 
         # The labelling.
         elif row[0] == 'Labelling:':
-            # Set the heteronucleus value.
-            value.set(row[1], 'heteronuc_type')
+            # Set the isotope value.
+            set_spin_isotope(isotope=row[1])
 
             # Name the spins.
             name = split('([A-Z]+)', row[1])[1]




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