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Anionic Tetrahedral Complexes as Serine Protease Inhibitors

โœ Scribed by Michael Shokhen; Dorit Arad


Publisher
Springer-Verlag
Year
1996
Tongue
English
Weight
104 KB
Volume
2
Category
Article
ISSN
1610-2940

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Quantum mechanical ab initio (RHF/6-31ุ‰G\*//RHF/3-21G) calculations were used to simulate the formation of the tetrahedral complex intermediate (TC) in serine protease active site by substrates and transition-state analog inhibitors. The enzyme active site was simulated by an assembly of the amino a