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Chai-1

  • Description

    a multi-modal foundation model for molecular structure prediction that performs at the state-of-the-art across a variety of benchmarks. Chai-1 enables unified prediction of proteins, small molecules, DNA, RNA, glycosylations, and more.

  • Usage

    To list all executables provided by Chai-1, run: $ sbgrid-list chai-1 Copy to clipboard

  • Usage Notes

    SBGrid curated chai-1 provides the following callable programs: $ sbgrid-list chai-1 chai python.chai The environment variable CHAI_DOWNLOADS_DIR must be set to a directory for which you have write permission. Example: export CHAI_DOWNLOADS_DIR=$(pwd)/chai_weights The default is to write into the chai-1 program directory. This is not allowed under the /programs SBGrid directory tree.

  • Installation

    Use the following command to install this title with the CLI client: $ sbgrid-cli install chai-1 Copy to clipboard Available operating systems: Linux 64

  • Citation Note

    Please cite the preprint at: https://www.biorxiv.org/content/early/2024/10/11/2024.10.10.615955


  • Keywords

    Computational Chemistry

  • Default Versions

    Linux 64:  0.5.2 (5.8 GB)

  • Developers

    Joshua Meier, Alex Rogozhnikov, Vinicius Reis, Kevin Wu, Jacques Boitreaud, Jack Dent, Matthew McPartlon

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