Quantum Effects in Enzyme Kinetics
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چکیده
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منابع مشابه
Quantum mechanical methods for enzyme kinetics.
This review discusses methods for the incorporation of quantum mechanical effects into enzyme kinetics simulations in which the enzyme is an explicit part of the model. We emphasize three aspects: (a) use of quantum mechanical electronic structure methods such as molecular orbital theory and density functional theory, usually in conjunction with molecular mechanics; (b) treating vibrational mot...
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