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Relax 1.3.11

519 bytes removed, 21:17, 16 October 2020
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Switch to the {{bmrblib homepage}} template to remove dead Gna! links.
| type = Major feature
| date = 12 August 2011
| manual = yes
}}
* Support for the creation of NMR-STAR version 3.1 files for BMRB deposition of model-free analysis results.
* Support for the reading of all versions of NMR-STAR files containing model-free or relaxation data from the BMRB.
* Use of the new [http://gna.org/projects/{{bmrblib homepage}} bmrblib library] for BMRB integration support.
* Activated the PDC peak intensity type reading.
* Added the Bruker PDC to the [http://www.nmr-relax.com/manual/bmrb_software_select.html exp_info.software_select user function] back end.
* Changed the "Help->Contact relaxGUI" to "Help->Mailing list contact".
* Renamed the "Relaxation time [s]" column to "Relaxation delay [s]" in the GUI as this is a more correct description.
* Deleted [https://gna.org/users/bugman {{relax developer link|username=Sw|text=Edward's] }} ancient Melbourne Uni email address from the MEDLINE info.
* Normalisation of the text in the auto model-free analysis GUI tab. The font sizes are now all the same, the text is not right aligned (not seen under Linux but very ugly in Windows), and semicolon usage and capitalisation is normalised.
* Regularisation of the font formatting in the steady-state NOE GUI tab.
* Opened files are closed properly after writing in the final_data_extraction.py sample script.
* If no diffusion tensor is present, creation of diffusion pdb will be skipped (final_data_extraction.py sample script).
* Updates for the Dasha [[DASHA]] sample script for the current version of relax.
* Updates for the diffusion tensor optimization sample script for the current version of relax.
* Some fixes for the subprocess.Popen() calls on MS Windows.
For reference, the following links are also part of the announcement for this release:
* [http://wiki.nmr-relax.com/Relax_1.3.11 Official release notes]
* [https://{{gna link|url=gna.org/forum/forum.php?forum_id=2292 |text=Gna! news item]}}
* [http://article.gmane.org/gmane.science.nmr.relax.announce/31 Gmane]
* [http://www.mail-archive.com/relax-announce%40gna.org/msg00023.html Mail archive]
== 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{{#lst://dx.doi.org/10.1039/b702202f 10.1039/b702202f]).Citations|dAuvergneGooley07}}* [*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{{#lst://dx.doi.org/10.1007/s10858-007-9213-3 10.1007/s10858-007-9213-3]).<section end=references/>Citations|dAuvergneGooley08b}}
<HarvardReferences />
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