Sun Yat-sen University; Fudan University; Galixir Technologies; Galixir Technologies, Sun Yat-sen University
Wei Lu, Qifeng Wu, Jixian Zhang, Jiahua Rao, Chengtao Li, Shuangjia Zheng
drug-protein interaction;protein-ligand docking;molecular docking;drug discovery;proteins;molecules;geometry deep learning;trigonometry;deep learning;neural networks
TANKBind: Trigonometry-Aware Neural NetworKs for Drug-Protein Binding Structure Prediction