How AI is Changing Chemical Discovery

While engineering, finance, and commerce have profited immensely from novel algorithms, they are not the only ones. Large-scale computation has been an integral part of the toolkit in the physical sciences for many decades - and some of the recent advances in AI have started to change how scientific discoveries are made. There has been a lot of excitement about prominent achievements in the physical sciences, like using machine learning to render an image of a black hole or the contribution of AlphaFold towards protein folding. This article will cover some of the more prominent usages of AI in chemistry, the parent discipline of the aforementioned protein folding problem. One of the chief goals of chemistry is to understand matter, its properties, and the transformations it can undergo.