relax
 

relax 4.1.0

relax : Molecular dynamics studying tool that can analyze large NMR data sets, providing support for various models and using Python as its main language



relax is a Python-based application that targets the study of molecular dynamics, providing a comprehensive set of tools for analyzing NMR data. Relying on the experience of professional spectroscopists, relax comes with support for a variety of biomolecules, DNa, RNA, organic molecules, sugars or proteins.relax implements a system that can process data according to the Lipari and Szabo model, determine the Rx NMR relaxation rates, perform consistency testing, calculate NOE NMR relaxation data, perform density mapping, and stereochemistry studies. It can work with both numeric and analytic models for CPMG-type experiments, and offers users accurate optimisation algorithms to work with.The advantage of relax is that it is compatible with input data created by various other NMR software solutions, while also generating output results in a wide range of formats. Resulting data can be visualized by interacting with third-party programs, such as MOLMOL, Grace, and OpenDX.Its flexible and variate array of data analysis and processing tools enable users to perform Monte Carlo simulations, study domain motions, and perform relaxation dispersion analysis using single, double, zero, multiple and combined quantum CPMG-type data.relax runs in the command prompt and uses Python as its programming language. It supports scripting, allowing the automation of data analysis. Alternatively, it comes with an intuitive GUI that offers one-click access to a plethora of user functions, making it easier to work with. Furthermore, the integrated wizards can guide you through all the needed steps when performing an analysis.
  • Numpy
  • wxPython (required for GUI)

  • Conclusion

    To conclude relax works on Windows operating system(s) and can be easily downloaded using the below download link according to GNU Public License license. relax download file is only 97.4 MB  in size.
    relax was filed under the Science and Engineering category and was reviewed in softlookup.com and receive 5/5 Score.
    relax has been tested by our team against viruses, spyware, adware, trojan, backdoors and was found to be 100% clean. We will recheck relax when updated to assure that it remains clean.

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    Popularity 10/10 - Downloads - 57 - Score - 5/5

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    Category: Science and Engineering 
    Publisher: The relax project
    Last Updated: 27/11/2023
    Requirements: Not specified
    License: GNU Public License
    Operating system: Windows
    Hits: 760
    File size: 97.4 MB 
    Price: Not specified


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