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Tutorial for adding relaxation dispersion models to relax

51 bytes removed, 09:36, 3 September 2013

Removed the numbers from the sections - the numbers are added to the list of contents at the top.

=== 1) Adding the model to the list. ===

Reference commit: http://article.gmane.org/gmane.science.nmr.relax.scm/17611

=== 2) The relax_disp.select_model user function front end. ===

Reference commit: http://article.gmane.org/gmane.science.nmr.relax.scm/17612

added there as well.

=== 3) The relax library. ===

Reference commit: http://article.gmane.org/gmane.science.nmr.relax.scm/17615

=== 4) The target function. ===

Reference commits:

=== 5) Adding support for the parameters. ===

Reference commit: http://article.gmane.org/gmane.science.nmr.relax.scm/17573

=== 6) The relax_disp.select_model back end. ===

Reference commit: http://article.gmane.org/gmane.science.nmr.relax.scm/17622

=== 7) The test suite. ===

Reference commits:

=== 8) Comparing to other software. ===

It can happen that a bug present in the lib.dispersion package code is

=== 9) Debugging. ===

This step should not require an explanation. It goes hand-in-hand

=== ~~10)~~ The auto-analysis. ===

The model variable in specific_analyses.relax_disp.variables needs to be imported into the auto_analyses.relax_disp module. This is then used in the write_results() method to output text files and Grace plots of the parameters. Be sure that the model variable is added to each part of this method corresponding to the parameters of the model.

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