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Huiming Bao

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Open access Jul 2026

A Preparation-Free Mixture-of-Experts Framework for Protein-Ligand Affinity Prediction

The resulting model, HydrAffinity, is an interaction-free, dynamic sparse model that uses pre-trained encoders and MoE for parameter-efficient learning and outperforms all interaction-free methods and matches state-of-the-art interaction-based methods on CASF-2016.

Huiming Bao, Shouliang Dong · 0 citations