World Journal of
Pharmaceutical and Life Sciences

( An ISO 9001:2015 Certified International Journal )

An International Peer Reviewed Journal for Pharmaceutical and Life Sciences
An Official Publication of Society for Advance Healthcare Research (Reg. No. : 01/01/01/31674/16)
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Abstract

FROM DATA TO DRUGS: THE ROLE OF ARTIFICIAL INTELLIGENCE AND MACHINE LEARNING IN MODERN MEDICINAL CHEMISTRY

Mahesh Kumar N.*, Priya A. and Dr. Shachindra L. Nargund

ABSTRACT

This review explores how AI and machine learning are transforming medicinal chemistry by enhancing drug discovery processes such as target identification, screening, SAR modelling, and molecular design. It outlines key AI/ML methods, presents real-world case studies, and examines challenges like data quality and ethical concerns. Advances like transfer learning and explainable AI are also discussed, emphasizing the need for collaboration to fully harness AI’s potential in drug development.

GRAPHICAL ABSTRACT

 

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