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Inhibition of papain by isothiocyanates

โœ Scribed by C.S. Tang; Wen-Jing Tang

Book ID
115734257
Publisher
Elsevier Science
Year
1976
Weight
637 KB
Volume
452
Category
Article
ISSN
0005-2744

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## Abstract Various mechanisms for the reversible formation of a covalent tetrahedral complex (TC) between papain and peptidyl aldehyde inhibitors were simulated by DFT calculations, applying the quantum mechanical/self consistent reaction field (virtual solvent) [QM/SCRF(VS)] approach. Only one me