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Supported Applications

MassiveFold

  • Description

    is a tool designed to expand structure prediction sampling by optimizing the parallelization of AlphaFold-based predictions across GPU clusters.

  • Usage

    To list all executables provided by MassiveFold, run: $ sbgrid-list massivefold Copy to clipboard

  • Installation

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

  • Primary Citation*

    e. Raouraoua, C. Mirabello, T. Véry, C. Blanchet, B. Wallner, M. F. Lensink, and G. Brysbaert. 2024. MassiveFold: unveiling AlphaFold’s hidden potential with optimized and parallelized massive sampling. Nature Computational Science. 4: 824-828.


    • *Full citation information available through

  • Keywords

    Computational Chemistry

  • Default Versions

    Linux 64:  1.6.0 (1.5 GB)

  • Developers

    Thibaut Véry, Bjorn Wallner, Nessim Raouraoua, Christophe Blanchet, Guillaume Brysbaert, Claudio Mirabello, Marc F Lensink

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