r26174 - /trunk/specific_analyses/relax_disp/api.py -- October 06, 2014 - 18:03

Author: tlinnet
Date: Mon Oct  6 18:03:32 2014
New Revision: 26174

URL: http://svn.gna.org/viewcvs/relax?rev=26174&view=rev
Log:
Removed unused proton reference in relax_disp API calculate().

There is though some problems with these tests:
F     1.93 s for Relax_disp.test_korzhnev_2005_15n_dq_data
F     2.01 s for Relax_disp.test_korzhnev_2005_1h_mq_data
F     1.93 s for Relax_disp.test_korzhnev_2005_1h_sq_data

It is unsure where these comes from.

Bug #22754 (https://gna.org/bugs/index.php?22754): The minimise.calculate() 
does not calculate chi2 value for clustered residues.

Modified:
    trunk/specific_analyses/relax_disp/api.py

Modified: trunk/specific_analyses/relax_disp/api.py
URL: 
http://svn.gna.org/viewcvs/relax/trunk/specific_analyses/relax_disp/api.py?rev=26174&r1=26173&r2=26174&view=diff
==============================================================================
--- trunk/specific_analyses/relax_disp/api.py   (original)
+++ trunk/specific_analyses/relax_disp/api.py   Mon Oct  6 18:03:32 2014
@@ -286,11 +286,6 @@
                         skip = False
                 if skip:
                     continue
-
-                # Get the attached proton.
-                proton = None
-                if proton_mmq_flag:
-                    proton = return_attached_protons(spin_ids)[0]
 
                 # The back calculated values.
                 back_calc = back_calc_r2eff(spins=spins, spin_ids=spin_ids, 
store_chi2=True)