Open access
Jul 2026
SM-GAT: a safety-aware multi-task graph attention network for multi-target anti-diabetic lead discovery from natural products
This study establishes an interpretable multi-objective framework for safety-aware lead discovery, providing a computational framework for integrating traditional botanical resources into anti-diabetic lead discovery.
Jianxin Zhang, Hongyi Liu, Shengnan Guo
· Frontiers in Molecular Biosc... · 0 citations