mailr19824 - /branches/relax_disp/specific_analyses/relax_disp/cpmgfit.py


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Posted by edward on May 31, 2013 - 12:24:
Author: bugman
Date: Fri May 31 12:24:46 2013
New Revision: 19824

URL: http://svn.gna.org/viewcvs/relax?rev=19824&view=rev
Log:
Added support for the 'CR72' or 'Full_CPMG' model to the 
relax_disp.cpmgfit_input user function.


Modified:
    branches/relax_disp/specific_analyses/relax_disp/cpmgfit.py

Modified: branches/relax_disp/specific_analyses/relax_disp/cpmgfit.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/relax_disp/specific_analyses/relax_disp/cpmgfit.py?rev=19824&r1=19823&r2=19824&view=diff
==============================================================================
--- branches/relax_disp/specific_analyses/relax_disp/cpmgfit.py (original)
+++ branches/relax_disp/specific_analyses/relax_disp/cpmgfit.py Fri May 31 
12:24:46 2013
@@ -212,6 +212,17 @@
         file.write("Rex 0 100.0 100\n")
         file.write("tex 0 10.0 100\n")
 
+    # The function and parameters.
+    elif function == 'Full_CPMG':
+        # Function.
+        file.write("function Full_CPMG\n")
+
+        # Parameters.
+        file.write("R2 1 10 20\n")
+        file.write("papb 0.01 0.49 20\n")
+        file.write("dw 0 10.0 100\n")
+        file.write("kex 0.1 1.0 100\n")
+
     # The Grace setup.
     file.write("xmgr\n")
     file.write("@ xaxis label \"1/tcp (1/ms)\"\n")
@@ -273,7 +284,8 @@
 
     # A translation table (relax to CPMGFit models).
     translation = {
-        'LM63': 'CPMG'
+        'LM63': 'CPMG',
+        'CR72': 'Full_CPMG'
     }
 
     # No translation, so fail.




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