Open main menu

Changes

Relax 1.3.6

849 bytes added, 08:54, 13 September 2014
Added the dauvergne_protocol refs.
* Improved the diffusion tensor print out.
* pipe.delete() without args will now delete all data pipes.
* Added some checks to the dauvergne_protocol model-free analysis [d'Auvergne and Gooley, 2007][d'Auvergne and Gooley, 2008b] for the required previously optimised results.
* Shifted the steady-state NOE specific analysis code into its own package.
* Shifted the debug and pedantic flags into the __main__ namespace for better access from other modules.
* Fix for the failure of model elimination in the full analysis script (bug #13259).
* Added a catch in iso_cone_S_to_theta() for bad order parameters > 1.
* The attached proton PDB name is no longer hardcoded to 'H' in the dauvergne_protocol auto analysis[d'Auvergne and Gooley, 2007][d'Auvergne and Gooley, 2008b].
* When loading save states, data pipe names are always converted to a string to avoid unicode problems.
* Hardcoded the factorial() function to return support for Python 2.4 and 2.5.
{{:relax release announcements}}
 
= References =
 
<section start=references/>
* [*d'Auvergne and Gooley, 2007] d'Auvergne, E. J. and Gooley, P. R. (2007). Set theory formulation of the model-free problem and the diffusion seeded model-free paradigm. ''Mol. BioSyst.'', '''3'''(7), 483–494. (DOI: [http://dx.doi.org/10.1039/b702202f 10.1039/b702202f).
* [*d'Auvergne and Gooley, 2008b] d'Auvergne, E. J. and Gooley, P. R. (2008). Optimisation of NMR dynamic models II. A new methodology for the dual optimisation of the model-free parameters and the Brownian rotational diffusion tensor. ''J. Biomol. NMR'', '''40'''(2), 121-133. (DOI: [http://dx.doi.org/10.1007/s10858-007-9213-3 10.1007/s10858-007-9213-3]).
<section end=references/>
<HarvardReferences />
= See also =
Trusted, Bureaucrats
4,228

edits