mailr26171 - /trunk/specific_analyses/relax_disp/optimisation.py


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Posted by tlinnet on October 06, 2014 - 17:21:
Author: tlinnet
Date: Mon Oct  6 17:21:32 2014
New Revision: 26171

URL: http://svn.gna.org/viewcvs/relax?rev=26171&view=rev
Log:
Removed the checking of MODEL_LIST_MMQ, and spin.isotope from 
optimisation.back_calc_r2eff(), since this check is already covered.

Bug #22754 (https://gna.org/bugs/index.php?22754): The minimise.calculate() 
does not calculate chi2 value for clustered residues.

Modified:
    trunk/specific_analyses/relax_disp/optimisation.py

Modified: trunk/specific_analyses/relax_disp/optimisation.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/specific_analyses/relax_disp/optimisation.py?rev=26171&r1=26170&r2=26171&view=diff
==============================================================================
--- trunk/specific_analyses/relax_disp/optimisation.py  (original)
+++ trunk/specific_analyses/relax_disp/optimisation.py  Mon Oct  6 17:21:32 
2014
@@ -132,11 +132,6 @@
     @return:                    The back-calculated R2eff/R1rho value for 
the given spin.
     @rtype:                     numpy rank-1 float array
     """
-
-    # Skip protons for MMQ data.
-    for spin in spins:
-        if spin.model in MODEL_LIST_MMQ and spin.isotope == '1H':
-            return
 
     # Create the initial parameter vector.
     param_vector = assemble_param_vector(spins=spins)




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