Articles with "repository chemically" as a keyword



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OSCAR: an extensive repository of chemically and functionally diverse organocatalysts

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Published in 2022 at "Chemical Science"

DOI: 10.1039/d2sc04251g

Abstract: The automated construction of datasets has become increasingly relevant in computational chemistry. While transition-metal catalysis has greatly benefitted from bottom-up or top-down strategies for the curation of organometallic complexes libraries, the field of organocatalysis is… read more here.

Keywords: extensive repository; chemically functionally; repository; repository chemically ... See more keywords