BioinformaticsbioRxivPreprint
Target-specific design of drug-like PPI inhibitors via hot-spot-guided generative deep learning
Heqi Sun, Jiayi Li, Yufang Zhang…·Dong‐Qing Wei
This paper introduces Hot2Mol, a deep learning framework for designing drug-like PPI inhibitors by generating molecules that mimic hot-spot residues, showing improved performance over baselines.