Open access
Jul 2026
AlphaDTA: integrating AlphaFold3 embeddings and 3D complex structures for drug-target binding affinity prediction.
By integrating AlphaFold3-derived single, pair, and structure-based embeddings through adaptive fusion, AlphaDTA improves generalization on structurally nonredundant benchmarks and demonstrates utility for target-specific drug repurposing.
Minjae Chung, Sejin Park, Hyunju Lee
· Journal of Cheminformatics · 0 citations