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Published in 2022 at "Informatics"
DOI: 10.3390/informatics9010008
Abstract: Small-molecule drug design aims to identify inhibitors that can specifically bind to a functionally important region on the target, i.e., an active site of an enzyme. Identification of potential binding pockets is typically based on…
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Keywords:
cryptic pockets;
relevant opening;
opening cryptic;
features ligands ... See more keywords