Author: bugman
Date: Thu Oct 9 17:32:59 2014
New Revision: 26224
URL: http://svn.gna.org/viewcvs/relax?rev=26224&view=rev
Log:
Removed a few triple spaces in the CHANGES document.
Modified:
trunk/docs/CHANGES
Modified: trunk/docs/CHANGES
URL:
http://svn.gna.org/viewcvs/relax/trunk/docs/CHANGES?rev=26224&r1=26223&r2=26224&view=diff
==============================================================================
--- trunk/docs/CHANGES (original)
+++ trunk/docs/CHANGES Thu Oct 9 17:32:59 2014
@@ -1224,7 +1224,7 @@
* Fix for the test_nesting_param_5 unit test. The 'r1' parameter is
now dynamic and hence will not be present in the initial list.
* One final fix for the Model_class.params list with 'r1'. The
is_r1_optimised() function is now called with the model name argument, as
required.
* Updated the relax_disp.r1_fit user function docstring. This now
includes information about which models support R1 parameter optimisation.
- * Removed results files to allow the
Relax_disp.test_r1rho_kjaergaard_missing_r1 system test to pass. These are
the
test_suite/shared_data/dispersion/Kjaergaard_et_al_2013/check_graphs/mc_2000/
results files for the 'No Rex' and 'DPL94' models, as well as the final run.
This commit is to allow the test to temporarily pass. It can be reverted once
a better solution is discussed and decided upon.
+ * Removed results files to allow the
Relax_disp.test_r1rho_kjaergaard_missing_r1 system test to pass. These are the
test_suite/shared_data/dispersion/Kjaergaard_et_al_2013/check_graphs/mc_2000/
results files for the 'No Rex' and 'DPL94' models, as well as the final run.
This commit is to allow the test to temporarily pass. It can be reverted once
a better solution is discussed and decided upon.
* Altered the number of Monte Carlo simulations in test script to 2000.
* Merger of the 'No Rex' and 'No Rex R1rho off res' models in the
specific_analyses.relax_disp package. In the 'variables' module, all
*_NOREX_R1RHO variables have simply been deleted and the MODEL_LIST_*
structures updated. For the 'data' module, the is_r1_optimised() function was
modified to catch the 'No Rex' model and to then use the cdp.exp_type_list
structure to determine if the experiment type is EXP_TYPE_R1RHO. This will be
modified in the future by using a function for determining if the current
experiment is on or off-resonance. The return_r1_data() and
return_r1_err_data() functions have also been modified to check if R1 values
are fit rather than if the model is in MODEL_LIST_R1RHO_OFF_RES. In the
'model' module, in addition to deleting all *_NOREX_R1RHO variables, the
convert_no_rex() function has also been deleted as it no longer serves a
purpose. In the 'checks' module, all 'No Rex R1rho off res' model references
have been replaced with 'No Rex'.
* Updated the dispersion auto-analysis for the universal 'No Rex'
model. The 'No Rex R1rho off res' references have all been deleted. The model
conversion logic is also no longer needed and has been deleted.
@@ -1410,7 +1410,7 @@
* Added all gyromagnetic ratio information from lib.physical_constants
to lib.periodic_table. The Periodic_table.gyromagnetic_ratio() method has been
added to allow this value to be easily returned.
* Added to back-end of R2eff estimate module, to be able to switch
between the function Jacobian or the chi2 Jacobian. Task #7822
(https://gna.org/task/?7822): Implement user function to estimate R2eff and
associated errors for exponential curve fitting.
* Modified user function 'relax_disp.r2eff_err_estimate', to be able
switch between the Jacobians. Task #7822 (https://gna.org/task/?7822):
Implement user function to estimate R2eff and associated errors for exponential
curve fitting.
- * Modified system test
Relax_disp.verify_estimate_r2eff_err_compare_mc, to try the difference between
the Jacobian. The results are: Printing the estimated R2eff error as function
of estimation from covariance and number of Monte Carlo simulations. Task
#7822 (https://gna.org/task/?7822): Implement user function to estimate R2eff
and associated errors for exponential curve fitting.
+ * Modified system test
Relax_disp.verify_estimate_r2eff_err_compare_mc, to try the difference between
the Jacobian. The results are: Printing the estimated R2eff error as function
of estimation from covariance and number of Monte Carlo simulations. Task
#7822 (https://gna.org/task/?7822): Implement user function to estimate R2eff
and associated errors for exponential curve fitting.
* Deleted the gyromagnetic ratio values and
return_gyromagnetic_ratio() function from lib.physical_constants.
* Shifted all of relax to use the lib.periodic_table module for
gyromagnetic ratios. The values and value returning function have been removed
from lib.physical_constants and replaced by the
Periodic_table.gyromagnetic_ratio() method in the lib.periodic_table module.
* Started making functions in R2eff estimate module, independent on
the informations stored in the Class. Task #7822 (https://gna.org/task/?7822):
Implement user function to estimate R2eff and associated errors for exponential
curve fitting.
_______________________________________________
relax (http://www.nmr-relax.com)
This is the relax-commits mailing list
[email protected]
To unsubscribe from this list, get a password
reminder, or change your subscription options,
visit the list information page at
https://mail.gna.org/listinfo/relax-commits
