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Id: #1418
System Name: relax
Name: relax
Group Type: Programs

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relax

The software package 'relax' is designed for the study of molecular dynamics through the analysis of experimental NMR data. Organic molecules, proteins, RNA, DNA, sugars, and other biomolecules are all supported. It supports exponential curve fitting for the calculation of the R1 and R2 relaxation rates, calculation of the NOE, reduced spectral density mapping, the Lipari and Szabo model-free analysis, study of domain motions via the N-state model and frame order dynamics theories using anisotropic NMR parameters such as RDCs and PCSs, the investigation of stereochemistry in dynamic ensembles, and the analysis of relaxation dispersion data.

Websites

The relax homepage is located at http://www.nmr-relax.com. The relax wiki is located at http://wiki.nmr-relax.com.

Details

Registration Date: Thu 08 Dec 2005 05:25:14 AM UTC
License: GNU General Public License V3 or later
Development Status: 5 - Production/Stable

 

Latest News 
relax version 3.2.3.
     posted by bugman, Thu 03 Jul 2014 12:10:24 PM UTC - 0 replies

Description

This is a major bugfix release and the first requiring numpy >= 1.6 to allow for faster calculations for certain analyses. There have been improvements to the GUI user functions, the ^[[?1034h escape code is finally suppressed ...


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relax version 3.2.2.
     posted by bugman, Thu 05 Jun 2014 02:15:52 PM UTC - 0 replies

Description

This is a major feature and bugfix release. It includes a large speed up of all analytic relaxation dispersion models, the correct handling of edge case failures in all models of the dispersion analysis, a number of fixes for the ...


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relax version 3.2.1.
     posted by bugman, Fri 23 May 2014 02:01:35 PM UTC - 0 replies

Description

This is a major bugfix release which includes the equations for the "B14" and "B14 full" relaxation dispersion models, from Baldwin 2014 and introduced with relax version 3.2.0, now being calculated correctly, ...


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relax version 3.2.0.
     posted by bugman, Wed 21 May 2014 12:12:14 PM UTC - 2 replies

Description

This is a major feature release. It includes the addition of the new "B14" and "B14 full" relaxation dispersion models (from Baldwin 2014), a complete rearrangement of the module layout of the specific ...


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