NIH Center for Advancing Translational Sciences (NCATS)

Machine learning approaches as tools to accelerate drug discovery

12 December 2017 | By Alexey Zakharov, Anton Simeonov

Computational methods based on machine learning approaches are being introduced increasingly widely to screen the large number of molecules that have never participated in the drug discovery process, but which might have significant drug development potential. This article considers the latest advances in machine learning as applied to drug discovery...