De novo design of ligand binding and sensing with a physics based generative approach
Yanzhe Zhang, Yitao Ke, Rui Zhi, Qihan Jin, Yiqin Feng, Chentong Wang, Minchao Fang, Jinyang Liao, Dachuan Chen, Jiao Liu, Longxing Cao
This paper introduces a physics-based generative method for designing ligand-binding proteins and demonstrates its application in creating biosensors for small molecules and metal ions.
bioRxiv · Jul 14, 2026 · PreprintBioinformatics