A virtual drug-screening approach to conquer huge chemical libraries

A computational method has been devised to identify drug-candidate molecules from a library of billions of molecules using 100 times less computational power than is used by standard methods.

Bibliographic Details
Main Authors: Deane, C, Mokaya, M
Format: Journal article
Language:English
Published: Springer Nature 2021
Description
Summary:A computational method has been devised to identify drug-candidate molecules from a library of billions of molecules using 100 times less computational power than is used by standard methods.