DeepRLI: a multi-objective framework for universal protein–ligand interaction prediction
Haoyu Lin, Jintao Zhu, Shiwei Wang, Yibo Li, Jianfeng Pei, Luhua Lai · Digital Discovery · 2025
DeepRLI is a multi-objective deep learning framework for universal protein–ligand interaction prediction, applicable to binding affinity prediction, molecular docking, and virtual screening tasks, offering better guidance for drug discovery.