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  1. ZhiGroup/FDA ZhiGroup/FDA Public

    Folding-Docking-Affinity framework for protein-ligand affinity prediction

    Python 31 2

  2. SSVAE-for-electrolyte-molecule-design SSVAE-for-electrolyte-molecule-design Public

    The repository includes the semi-supervised VAE model and the execution script for molecular generation

    Python 5 2

  3. BFN_emb_smiles BFN_emb_smiles Public

    Using Bayesian Flow Networks (BFN) to generate molecular SMILES embedding

    Python

  4. ZhiGroup/DAVIS-complete ZhiGroup/DAVIS-complete Public

    Python 6