mailr21141 - /branches/relax_disp/auto_analyses/relax_disp.py


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Posted by edward on October 16, 2013 - 15:28:
Author: bugman
Date: Wed Oct 16 15:28:00 2013
New Revision: 21141

URL: http://svn.gna.org/viewcvs/relax?rev=21141&view=rev
Log:
Modified the relaxation dispersion auto-analysis to take nesting of MQ models.

This is specifically the nesting of the analytic 'MQ CR72' model and the 'MQ 
NS CPMG 2-site' models.
The analytic solution is now used as the optimisation starting point for the 
numeric model.


Modified:
    branches/relax_disp/auto_analyses/relax_disp.py

Modified: branches/relax_disp/auto_analyses/relax_disp.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/relax_disp/auto_analyses/relax_disp.py?rev=21141&r1=21140&r2=21141&view=diff
==============================================================================
--- branches/relax_disp/auto_analyses/relax_disp.py (original)
+++ branches/relax_disp/auto_analyses/relax_disp.py Wed Oct 16 15:28:00 2013
@@ -191,6 +191,9 @@
         if model in [MODEL_NS_CPMG_2SITE_3D, MODEL_NS_CPMG_2SITE_EXPANDED, 
MODEL_NS_CPMG_2SITE_STAR] and MODEL_CR72 in self.models:
             nested_pipe = MODEL_CR72
             analytic = True
+        elif model == MODEL_MQ_NS_CPMG_2SITE and MODEL_MQ_CR72 in 
self.models:
+            nested_pipe = MODEL_MQ_CR72
+            analytic = True
 
         # No nesting.
         if not nested_pipe:




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