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  1. openfold openfold Public

    Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2

    Python 3.2k 646

  2. openfold-3 openfold-3 Public

    A fully open source biomolecular structure prediction model based on AlphaFold3

    Python 461 47

  3. genie2 genie2 Public

    Protein structure diffusion model for unconditional protein generation and motif scaffolding

    Python 180 32

  4. rgn2 rgn2 Public

    Python 108 28

  5. proteinnet proteinnet Public

    Standardized data set for machine learning of protein structure

    Python 904 134

  6. hsm hsm Public

    Code associated with "Biophysical prediction of protein-peptide interactions and signaling networks using machine learning."

    Jupyter Notebook 70 21

Repositories

Showing 10 of 17 repositories
  • ring-flash-attention Public Forked from zhuzilin/ring-flash-attention

    Ring attention implementation with flash attention

    aqlaboratory/ring-flash-attention’s past year of commit activity
    Python 1 MIT 89 0 0 Updated Dec 4, 2025
  • openfold-3 Public

    A fully open source biomolecular structure prediction model based on AlphaFold3

    aqlaboratory/openfold-3’s past year of commit activity
    Python 461 Apache-2.0 47 15 (1 issue needs help) 6 Updated Dec 3, 2025
  • openfold Public

    Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2

    aqlaboratory/openfold’s past year of commit activity
    Python 3,218 Apache-2.0 646 203 (3 issues need help) 25 Updated Nov 20, 2025
  • TCRcube Public
    aqlaboratory/TCRcube’s past year of commit activity
    Python 9 Apache-2.0 0 0 0 Updated Apr 4, 2025
  • llnl-docs Public
    aqlaboratory/llnl-docs’s past year of commit activity
    0 0 0 0 Updated Mar 5, 2025
  • QuickBind Public

    A Light-Weight And Interpretable Molecular Docking Model

    aqlaboratory/QuickBind’s past year of commit activity
    Jupyter Notebook 24 MIT 2 2 0 Updated Oct 23, 2024
  • insilico_design_pipeline Public

    In-silico design pipeline for evaluating protein structure diffusion models.

    aqlaboratory/insilico_design_pipeline’s past year of commit activity
    Python 27 Apache-2.0 5 0 0 Updated Jun 25, 2024
  • genie2 Public

    Protein structure diffusion model for unconditional protein generation and motif scaffolding

    aqlaboratory/genie2’s past year of commit activity
    Python 180 Apache-2.0 32 7 1 Updated Jun 24, 2024
  • hsm Public

    Code associated with "Biophysical prediction of protein-peptide interactions and signaling networks using machine learning."

    aqlaboratory/hsm’s past year of commit activity
    Jupyter Notebook 70 MIT 21 2 1 Updated Apr 26, 2024
  • genie Public

    De Novo Protein Design by Equivariantly Diffusing Oriented Residue Clouds

    aqlaboratory/genie’s past year of commit activity
    Python 183 Apache-2.0 23 1 1 Updated Apr 21, 2024

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