mailr24174 - /branches/disp_spin_speed/target_functions/relax_disp.py


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Posted by tlinnet on June 19, 2014 - 21:05:
Author: tlinnet
Date: Thu Jun 19 21:05:53 2014
New Revision: 24174

URL: http://svn.gna.org/viewcvs/relax?rev=24174&view=rev
Log:
Removed the parsing of a matrix to the lib function of NS R1rho 2site.

Task #7807 (https://gna.org/task/index.php?7807): Speed-up of dispersion 
models for Clustered analysis.

Modified:
    branches/disp_spin_speed/target_functions/relax_disp.py

Modified: branches/disp_spin_speed/target_functions/relax_disp.py
URL: 
http://svn.gna.org/viewcvs/relax/branches/disp_spin_speed/target_functions/relax_disp.py?rev=24174&r1=24173&r2=24174&view=diff
==============================================================================
--- branches/disp_spin_speed/target_functions/relax_disp.py     (original)
+++ branches/disp_spin_speed/target_functions/relax_disp.py     Thu Jun 19 
21:05:53 2014
@@ -1603,7 +1603,7 @@
         self.r20_struct[:] = multiply.outer( r1rho_prime.reshape(self.NE, 
self.NS, self.NM), self.no_nd_ones )
 
         # Back calculate the R2eff values.
-        ns_r1rho_2site(M0=self.M0, matrix=self.matrix, 
r1rho_prime=self.r20_struct, omega=self.chemical_shifts, offset=self.offset, 
r1=self.r1, pA=pA, dw=self.dw_struct, kex=kex, 
spin_lock_fields=self.spin_lock_omega1, relax_time=self.relax_times, 
inv_relax_time=self.inv_relax_times, back_calc=self.back_calc, 
num_points=self.num_disp_points)
+        ns_r1rho_2site(M0=self.M0, r1rho_prime=self.r20_struct, 
omega=self.chemical_shifts, offset=self.offset, r1=self.r1, pA=pA, 
dw=self.dw_struct, kex=kex, spin_lock_fields=self.spin_lock_omega1, 
relax_time=self.relax_times, inv_relax_time=self.inv_relax_times, 
back_calc=self.back_calc, num_points=self.num_disp_points)
 
         # Clean the data for all values, which is left over at the end of 
arrays.
         self.back_calc = self.back_calc*self.disp_struct




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