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GTalign

  • Description

    a novel high-performance protein structure alignment, superposition and search method with flexible structure clustering ability.

  • Usage

    To list all executables provided by GTalign, run: $ sbgrid-list gtalign Copy to clipboard

  • Usage Notes

    SBGrid GTAlign provides two callable programs: gtalign_gpu, gtalign_mp Please see the simple usage example on our wiki: https://sbgrid.org/wiki/examples/gtalign

  • Installation

    Use the following command to install this title with the CLI client: $ sbgrid-cli install gtalign Copy to clipboard Available operating systems: Linux 64

  • Primary Citation*

    M. Margelevičius. 2024. GTalign: spatial index-driven protein structure alignment, superposition, and search. Nature communications. 15(1): 7305.


    • *Full citation information available through

  • Keywords

    Computational Chemistry

  • Default Versions

    Linux 64:  0.16.0-alpha (24.0 MB)

  • Developers

    Mindaugas Margelevičius

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