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Advancement of Artificial Intelligence in Chemical Sciences

Excellence Amaibiam Okonkwo,David Umahi,Kennedy Izuchukwu Ogunwa,Linda Mgbo Ngumoha

2025 · DOI: 10.55455/acsnigeria.1.2.142-148
International Conference on Advanced Computer Systems · 0 Citations

TLDR

The recent advancements, applications and future directions of AI in chemical sciences are discussed, highlighting its roles in shaping the future of chemical sciences.

Abstract

Artificial Intelligence (AI) is now being used in many areas of chemical sciences ranging from pharmaceutical chemistry, nanotechnology, analytical chemistry: faster and more precise compound identification in organic chemistry and easier complex organic synthesis. Integration of AI technologies in chemical sciences has enhanced reaction prediction, material design, drug discovery, and sustainability efforts. AI in chemical sciences has brought about a lot of transformation which is very essential for addressing global health, energy and environment challenges in line with sustainable development goals (SDGs). However, limitations such as data unavailability, difficult model interpretation, unreliability and scalability remain areas for further studies. This paper discusses the recent advancements, applications and future directions of AI in chemical sciences, highlighting its roles in shaping the future of chemical sciences.