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...models, fixes for a system test on 32-bit GNU/Linux, and a fix for running scripts with certain versions of Python. * Created a sample script to create a CSV file of model-free results for reading into spreadsh

...sub>, or the NOE) has been fixed as well as the out of date generate_ri.py sample script.

* Copyright statements added to the sample scripts for identifying the author and date of the script.

...directory and modified (using the <code>svn cp</code> command). Once the scripts are functional, they can be copied and modified for the truncated data (aga * Copy the full analysis script to <code>test_suite/system_tests/scripts/relax_disp/</code> with an appropriate name (always using the <code>svn cp<

* Fixes for the relax_curve_diff.py and latex_mf_table.py sample scripts (identified by the relax data store abstraction). ...reading of the results file in the 'final' stage of the 'full_analysis.py' sample script is fixed ({{gna bug link|12409}}).

* The ¹⁵N CSA values in the sample scripts are now all -172 ppm. * The 'angles.py' sample script no longer fails when residue specific relaxation data is missing (co

* Added elimination of Monte Carlo simulations to the sample scripts. * The 'full_analysis.py' sample script now only searches over 6⁶ rather than 11⁶ grid

== Get the process helper scripts == ...en from the relax disp manual, section 10.6.1 Dispersion script mode - the sample script

* Added two sample scripts for determining the populations of an ensemble of small molecules. This us * Scripts can now be run again under Python versions 2.4 or lower (by avoiding the ru

...if all issues are reported. Note that this is a development line and that scripts written for version [[relax 1.3.1|1.3.1]] may not work automatically in fut * The inclusion of headers in the sample scripts to identify the author and age of the script.

...ease do not expect either the backwards or forwards compatibility of relax scripts written for the 1.3 relax versions. * Added a sample script for the creation of the PDB representation of the diffusion tensor.

* Converted the reduced J(&omega;) mapping sample script to the relax 1.3 design to make it functional. * Addition of a sample script for the determination the relative stereochemistry of organic molecu

* Fix for the latex_mf_table.py sample script ([https://gna.org/bugs/?13163 bug #13163]). ...high te values (>200 ns) were not being eliminated in the full_analysis.py sample script ([https://gna.org/bugs/?13259 bug #13259]).

scripts mkdir peak_lists spectrometer_data scripts

* Setup for testing the sample_scripts/relax_disp/R1rho_analysis.py sample script. The script was copied into the test_suite/shared_data/dispersion/r ...relaxation dispersion auto-analysis options are now exposed by the sample scripts. This included the pre_run_dir argument for specifying a directory of resu

* A new sample script for loading a model-free results file and back-calculating relaxatio ...cate_title_check replicate_title_check target] has been added to the scons scripts. This calls the <code>find()</code> method of the replicate LaTeX title fi

| keywords = Bash completion, Speed, Sample scripts, Manual, Docker, Travis-CI, User function argument checking ...the GUI and in the execution of many relax user functions, improved sample scripts, significant relax manual updates, support for newer NMRPipe SeriesTab file

Maybe a combination of GUI and scripts? === Copy sample script ===

== Sample data to try dx == # See sample scripts

* Added the ability to skip scripts in the package __all__ list unit test checks. ...ual/value_write.html value.write user function]s to the J(&omega;) mapping sample script.

...ated the journal reference for the published lactose conformational search scripts. * Shifted some of the sample scripts into the analysis specific sub-directories.

* Syntax error fix for one of the unused scripts in the relax test suite shared data directories. This problem was encounte * Updates to the sample scripts for the [http://www.nmr-relax.com/manual/spectrum_read_intensities.html spe

....write user function not being able to write ref/sat plots as described in sample script noe.py]. Instead of trying to produce the 'ref.agr' and 'sat.agr' f ....write user function not being able to write ref/sat plots as described in sample script noe.py]. Instead of trying to produce the 'ref.agr' and 'sat.agr' f

* Updated the diffusion tensor minimisation sample script as the code is very old and useless. ...nts as well. This new flag is for backwards compatibility - it allows old scripts to operate as before while enabling the new functionality.

* Renamed test scripts and files for producing surface &chi;² plots. * Renamed sample scripts making surface maps.

...and uncommented a few lines of code. Of course, this won't work until the sample data has been introduced and the right names for the different files be inp * Added details to the readme file and changed the directory name where the sample data is located. The directory is now named 'dataset_1-a'. This contains

* The GUI test suite has been significantly expanded. The system test relax scripts can now be used as GUI tests - the user functions are executed through the * The dauvergne_protocol sample script[d'Auvergne and Gooley, 2007][d'Auvergne and Gooley, 2008b] initial p

...atest speed ups. There are also improvements for helping to upgrade relax scripts to newer relax versions. The numdifftools package is now bundled with rela ...anges from [[relax 1.0.1]] to [[relax 3.3.1|3.3.1]] to help with upgrading scripts to newer relax versions.

...This is in the base script used by all scripts in test_suite/system_tests/scripts/frame_order/cam/. ...This is in the base script used by all scripts in test_suite/system_tests/scripts/frame_order/cam/. The translation vector coordinates are now set, as well

...of interatomic distance, angle or parallax shift fluctuations, measured as sample standard deviations, between different molecules. * Updated the gnuplot scripts to be executable. These are the scripts created by the [http://www.nmr-relax.com/api/3.3/lib.plotting.gnuplot-modul

.../minimise_execute.html minimise.execute] respectively. Please update your scripts appropriately. A new relax feature is that old user function calls are det ...ames of the old and new user functions. This is for help in upgrading old scripts and is currently for the calc(), grid_search(), and minimise() user functio