mailr24985 - /branches/R1_fitting/auto_analyses/relax_disp.py


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Posted by tlinnet on August 12, 2014 - 10:54:
Author: tlinnet
Date: Tue Aug 12 10:54:41 2014
New Revision: 24985

URL: http://svn.gna.org/viewcvs/relax?rev=24985&view=rev
Log:
In auto analysis of relax_disp, started implementing the new nesting function.

sr #3135(https://gna.org/support/?3135): Optimisation of the R1 relaxation 
rate for the off-resonance R1rho relaxation dispersion models.

Modified:
    branches/R1_fitting/auto_analyses/relax_disp.py

Modified: branches/R1_fitting/auto_analyses/relax_disp.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/R1_fitting/auto_analyses/relax_disp.py?rev=24985&r1=24984&r2=24985&view=diff
==============================================================================
--- branches/R1_fitting/auto_analyses/relax_disp.py     (original)
+++ branches/R1_fitting/auto_analyses/relax_disp.py     Tue Aug 12 10:54:41 
2014
@@ -38,6 +38,7 @@
 from prompt.interpreter import Interpreter
 from specific_analyses.relax_disp.data import has_exponential_exp_type, 
has_cpmg_exp_type, has_fixed_time_exp_type, has_r1rho_exp_type, loop_frq
 from specific_analyses.relax_disp.data import INTERPOLATE_DISP, 
INTERPOLATE_OFFSET, X_AXIS_DISP, X_AXIS_W_EFF, X_AXIS_THETA, Y_AXIS_R2_R1RHO, 
Y_AXIS_R2_EFF
+from specific_analyses.relax_disp.variables import nesting_model
 from specific_analyses.relax_disp.variables import MODEL_CR72, 
MODEL_CR72_FULL, MODEL_LIST_ANALYTIC, MODEL_LIST_NEST, MODEL_LIST_NUMERIC, 
MODEL_LIST_R1RHO_FIT_R1, MODEL_LIST_R1RHO_W_R1, MODEL_LIST_R1RHO_FULL, 
MODEL_LM63, MODEL_LM63_3SITE, MODEL_MP05, MODEL_MMQ_CR72, MODEL_NOREX, 
MODEL_NOREX_R1RHO, MODEL_NOREX_R1RHO_FIT_R1, MODEL_NS_CPMG_2SITE_3D, 
MODEL_NS_CPMG_2SITE_3D_FULL, MODEL_NS_CPMG_2SITE_EXPANDED, 
MODEL_NS_CPMG_2SITE_STAR, MODEL_NS_CPMG_2SITE_STAR_FULL, MODEL_NS_MMQ_2SITE, 
MODEL_NS_MMQ_3SITE, MODEL_NS_MMQ_3SITE_LINEAR, MODEL_NS_R1RHO_2SITE, 
MODEL_NS_R1RHO_3SITE, MODEL_NS_R1RHO_3SITE_LINEAR, MODEL_PARAM_R20B, 
MODEL_PARAMS, MODEL_R2EFF, PARAMS_R20
 from status import Status; status = Status()
 
@@ -286,31 +287,11 @@
         subsection(file=sys.stdout, text="Nesting and model equivalence 
checks", prespace=1)
 
         # The simpler model.
-        nested_pipe = None
-        if model == MODEL_LM63_3SITE and MODEL_LM63 in self.models:
-            nested_pipe = self.name_pipe(MODEL_LM63)
-        if model == MODEL_CR72_FULL and MODEL_CR72 in self.models:
-            nested_pipe = self.name_pipe(MODEL_CR72)
-        if model == MODEL_MMQ_CR72 and MODEL_CR72 in self.models:
-            nested_pipe = self.name_pipe(MODEL_CR72)
-        if model == MODEL_NS_CPMG_2SITE_3D_FULL and MODEL_NS_CPMG_2SITE_3D 
in self.models:
-            nested_pipe = self.name_pipe(MODEL_NS_CPMG_2SITE_3D)
-        if model == MODEL_NS_CPMG_2SITE_STAR_FULL and 
MODEL_NS_CPMG_2SITE_STAR in self.models:
-            nested_pipe = self.name_pipe(MODEL_NS_CPMG_2SITE_STAR)
-        if model == MODEL_NS_MMQ_3SITE_LINEAR and MODEL_NS_MMQ_2SITE in 
self.models:
-            nested_pipe = self.name_pipe(MODEL_NS_MMQ_2SITE)
-        if model == MODEL_NS_MMQ_3SITE:
-            if MODEL_NS_MMQ_3SITE_LINEAR in self.models:
-                nested_pipe = self.name_pipe(MODEL_NS_MMQ_3SITE_LINEAR)
-            elif MODEL_NS_MMQ_2SITE in self.models:
-                nested_pipe = self.name_pipe(MODEL_NS_MMQ_2SITE)
-        if model == MODEL_NS_R1RHO_3SITE_LINEAR and MODEL_NS_R1RHO_2SITE in 
self.models:
-            nested_pipe = self.name_pipe(MODEL_NS_R1RHO_2SITE)
-        if model == MODEL_NS_R1RHO_3SITE:
-            if MODEL_NS_R1RHO_3SITE_LINEAR in self.models:
-                nested_pipe = self.name_pipe(MODEL_NS_R1RHO_3SITE_LINEAR)
-            elif MODEL_NS_R1RHO_2SITE in self.models:
-                nested_pipe = self.name_pipe(MODEL_NS_R1RHO_2SITE)
+        nested_model = nesting_model(self_models=self.models, model=model)
+        if nested_model != None:
+            nested_pipe = self.name_pipe(nested_model)
+        else:
+            nested_pipe = None
 
 
         # Using the analytic solution.




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