Author: bugman
Date: Fri Apr 11 18:27:42 2014
New Revision: 22720
URL: http://svn.gna.org/viewcvs/relax?rev=22720&view=rev
Log:
Fixes for the definitions of the 'theta' and 'w_eff' relaxation dispersion
parameters.
These should not be manually changed by the user and they are not optimised
parameter. Therefore
they have been shifted from the set 'params' to the set 'all', to avoid
listing them in the
parameter tables (for example in the value.set user function).
Modified:
trunk/specific_analyses/relax_disp/parameter_object.py
Modified: trunk/specific_analyses/relax_disp/parameter_object.py
URL:
http://svn.gna.org/viewcvs/relax/trunk/specific_analyses/relax_disp/parameter_object.py?rev=22720&r1=22719&r2=22720&view=diff
==============================================================================
--- trunk/specific_analyses/relax_disp/parameter_object.py (original)
+++ trunk/specific_analyses/relax_disp/parameter_object.py Fri Apr 11
18:27:42 2014
@@ -79,8 +79,8 @@
self._add('kB', scope='spin', default=10000.0, desc='Approximate
chemical exchange rate constant between sites A and B (rad.s^-1)',
set='params', py_type=float, grace_string='\\qk\\sB\\N\\Q (rad.s\\S-1\\N)',
err=True, sim=True)
self._add('kC', scope='spin', default=10000.0, desc='Approximate
chemical exchange rate constant between sites A and C (rad.s^-1)',
set='params', py_type=float, grace_string='\\qk\\sC\\N\\Q (rad.s\\S-1\\N)',
err=True, sim=True)
self._add('tex', scope='spin', default=1.0/10000.0, desc='The time
of exchange (tex = 1/kex)', set='params', py_type=float,
grace_string='\\q\\xt\\B\\sex\\N\\Q (s.rad\\S-1\\N)', err=True, sim=True)
- self._add('theta', scope='spin', desc='Rotating frame tilt angle : (
theta = arctan(w_1 / Omega) ) (rad)', set='params', grace_string='Rotating
frame tilt angle (rad)', py_type=dict, err=False, sim=False)
- self._add('w_eff', scope='spin', desc='Effective field in rotating
frame : ( w_eff = sqrt(Omega^2 + w_1^2) ) (rad.s^-1)',
grace_string='Effective field in rotating frame (rad.s\\S-1\\N)',
set='params', py_type=dict, err=False, sim=False)
+ self._add('theta', scope='spin', desc='Rotating frame tilt angle : (
theta = arctan(w_1 / Omega) ) (rad)', grace_string='Rotating frame tilt angle
(rad)', py_type=dict, set='all', err=False, sim=False)
+ self._add('w_eff', scope='spin', desc='Effective field in rotating
frame : ( w_eff = sqrt(Omega^2 + w_1^2) ) (rad.s^-1)',
grace_string='Effective field in rotating frame (rad.s\\S-1\\N)',
py_type=dict, set='all', err=False, sim=False)
self._add('k_AB', scope='spin', default=10000.0, desc='The exchange
rate from state A to state B', set='params', py_type=float,
grace_string='\\qk\\sAB\\N\\Q (rad.s\\S-1\\N)', err=True, sim=True)
self._add('k_BA', scope='spin', default=10000.0, desc='The exchange
rate from state B to state A', set='params', py_type=float,
grace_string='\\qk\\sBA\\N\\Q (rad.s\\S-1\\N)', err=True, sim=True)
r22720 - /trunk/specific_analyses/relax_disp/parameter_object.py