A virtual drug-screening approach to conquer huge chemical libraries

Charlotte Deane () and Maranga Mokaya

Nature, 2022, vol. 601, issue 7893, 322-323

Abstract: 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.

Keywords: Drug discovery; Chemical biology; Structural biology (search for similar items in EconPapers)
Date: 2022
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DOI: 10.1038/d41586-021-03682-1

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