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Enantioselectivity in Candida antarctica lipase B: A molecular dynamics study

A major problem in predicting the enantioselectivity of an enzyme toward substrate molecules is that even high selectivity toward one substrate enantiomer over the other corresponds to a very small difference in free energy. However, total free energies in enzyme-substrate systems are very large and...

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Detalhes bibliográficos
Main Authors: Raza, Sami, Fransson, Linda, Hult, Karl
Formato: Artigo
Idioma:Inglês
Publicado em: Cold Spring Harbor Laboratory Press 2001
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2373953/
https://ncbi.nlm.nih.gov/pubmed/11266619
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