r21565 - /branches/relax_disp/test_suite/shared_data/dispersion/Hansen/relax_results/relax_disp.py -- November 20, 2013 - 22:00

Author: bugman
Date: Wed Nov 20 22:00:13 2013
New Revision: 21565

URL: http://svn.gna.org/viewcvs/relax?rev=21565&view=rev
Log:
Updated the relax script for optimising Flemming Hansen's CPMG data.


Modified:
    
branches/relax_disp/test_suite/shared_data/dispersion/Hansen/relax_results/relax_disp.py

Modified: 
branches/relax_disp/test_suite/shared_data/dispersion/Hansen/relax_results/relax_disp.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/relax_disp/test_suite/shared_data/dispersion/Hansen/relax_results/relax_disp.py?rev=21565&r1=21564&r2=21565&view=diff
==============================================================================
--- 
branches/relax_disp/test_suite/shared_data/dispersion/Hansen/relax_results/relax_disp.py
 (original)
+++ 
branches/relax_disp/test_suite/shared_data/dispersion/Hansen/relax_results/relax_disp.py
 Wed Nov 20 22:00:13 2013
@@ -24,6 +24,18 @@
 # The number of Monte Carlo simulations to be used for error analysis at the 
end of the analysis.
 MC_NUM = 50
 
+# The results directory.
+RESULTS_DIR = '.'
+
+# The model selection technique to use.
+MODSEL = 'AIC'
+
+# The flag for only using numeric models in the final model selection.
+NUMERIC_ONLY = False
+
+# The R2eff value in rad/s by which to judge insignificance.  If the maximum 
difference between two points on all dispersion curves for a spin is less 
than this value, that spin will be deselected.
+INSIGNIFICANCE = 1.0
+
 
 
 # Create the data pipe.
@@ -45,4 +57,4 @@
 ##########################
 
 # Do not change!
-Relax_disp(pipe_name=pipe_name, pipe_bundle=pipe_bundle, models=MODELS, 
grid_inc=GRID_INC, mc_sim_num=MC_NUM)
+Relax_disp(pipe_name=pipe_name, pipe_bundle=pipe_bundle, 
results_dir=RESULTS_DIR, models=MODELS, grid_inc=GRID_INC, mc_sim_num=MC_NUM, 
modsel=MODSEL, insignificance=INSIGNIFICANCE, numeric_only=NUMERIC_ONLY)