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A series of 45 peptide inhibitors was designed, synthesized, and evaluated against the NS2B–NS3 proteases of the four subtypes of dengue virus, DEN-1–4. The design was based on proteochemometric models for Michaelis (K m ) and cleavage rate constants (k cat ) of protease substrates. This led first to octapeptides showing submicromolar or low micromolar inhibitory activities on the...
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