crossrefInternational Journal of Molecular Sciences2025-07-16Cited by 18
Digital Alchemy: The Rise of Machine and Deep Learning in Small-Molecule Drug Discovery
Abdul Manan, Eunhye Baek, Sidra Ilyas, Donghun Lee
This review provides a comprehensive analysis of the transformative impact of artificial intelligence (AI) and machine learning (ML) on modern drug design, specifically focusing on how these advanced computational techniques address the inherent limitations of traditional small-m…