relax / SVN archive Commit Log

Commit	Date
[r22431] by tlinnet Added link to manual for calculating NMR parameters in the doctring for lib.rotating_frame.py. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.	2014-03-07 10:42:48	Tree
[r22430] by tlinnet Added unittest file _lib.test_rotating_frame(). Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. These unittest will be used to calculate and return dictionaries of tilt_angles, Delta_omega and omega_eff. Some of the R1rho data mentioned in: http://www.nmr-relax.com/manual/Dispersion_model_summary.html.	2014-03-07 10:42:46	Tree
[r22429] by tlinnet Added unittest file _lib.test_rotating_frame.py to __init__.py. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.	2014-03-07 10:42:45	Tree
[r22428] by tlinnet Added rotating_frame to lib.__init__.py. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.	2014-03-07 10:42:43	Tree
[r22427] by tlinnet Added lib.rotating_frame module containing functions related to rotating frame NMR calculations. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.	2014-03-07 10:42:36	Tree
[r22426] by bugman Preparatory change for the citations in the GUI.	2014-03-07 10:19:57	Tree
[r22425] by bugman Created a new citation for relax which concatenates both the d'Auvergne and Gooley 2008 papers. This is to show to those who are unaware of back-to-back paper concatenation rules how to cite both papers using one reference, saving a lot of space.	2014-03-07 10:17:49	Tree
[r22424] by tlinnet Added a sample_script to generate theta values for R1rho data. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. The script is explained at the wiki: http://wiki.nmr-relax.com/Sample_scripts.relax_disp.return_offset_data	2014-03-06 21:45:21	Tree
[r22423] by tlinnet Removed import of: from specific_analyses.relax_disp.disp_data import return_param_key_from_data in unit test. Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff. This import is not needed.	2014-03-06 21:45:14	Tree
[r22422] by bugman Added the OMP relaxation rates and compressed PDB file to the repository. This is to allow users to have a full data set to perform a test model-free analysis with.	2014-03-06 20:26:52	Tree

[r22431] by tlinnet

Added link to manual for calculating NMR parameters in the doctring for lib.rotating_frame.py.

Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.

2014-03-07 10:42:48

Tree

[r22430] by tlinnet

Added unittest file _lib.test_rotating_frame().

Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.

These unittest will be used to calculate and return dictionaries of tilt_angles, Delta_omega and omega_eff.
Some of the R1rho data mentioned in: http://www.nmr-relax.com/manual/Dispersion_model_summary.html.

2014-03-07 10:42:46

Tree

[r22429] by tlinnet

Added unittest file _lib.test_rotating_frame.py to __init__.py.

Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.

2014-03-07 10:42:45

Tree

[r22428] by tlinnet

Added rotating_frame to lib.__init__.py.

Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.

2014-03-07 10:42:43

Tree

[r22427] by tlinnet

Added lib.rotating_frame module containing functions related to rotating frame NMR calculations.

Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.

2014-03-07 10:42:36

Tree

[r22426] by bugman

Preparatory change for the citations in the GUI.

2014-03-07 10:19:57

Tree

[r22425] by bugman

Created a new citation for relax which concatenates both the d'Auvergne and Gooley 2008 papers.

This is to show to those who are unaware of back-to-back paper concatenation rules how to cite both
papers using one reference, saving a lot of space.

2014-03-07 10:17:49

Tree

[r22424] by tlinnet

Added a sample_script to generate theta values for R1rho data.

Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.

The script is explained at the wiki: http://wiki.nmr-relax.com/Sample_scripts.relax_disp.return_offset_data

2014-03-06 21:45:21

Tree

[r22423] by tlinnet

Removed import of: from specific_analyses.relax_disp.disp_data import return_param_key_from_data in unit test.

Regarding sr #3124, (https://gna.org/support/index.php?3124) - Grace graphs production for R1rho analysis with R2_eff as function of Omega_eff.

This import is not needed.

2014-03-06 21:45:14

Tree

[r22422] by bugman

Added the OMP relaxation rates and compressed PDB file to the repository.

This is to allow users to have a full data set to perform a test model-free analysis with.

2014-03-06 20:26:52

Tree

relax SVN archive

Molecular dynamics by NMR data analysis

SVN archive Commit Log