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    Quantum mechanical/molecular mechanical study of three stationary points along the deacylation step of the catalytic mechanism of elastase

    A large amount of experimental as well as theoretical information is available about the mechanism of serine proteases, but many questions remain unanswered. Here we study the deacylation step of the reaction...

    Maya Topf, Péter Várnai, W. Graham Richards in Theoretical Chemistry Accounts (2001)