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Mechanisms of metal-dependent non-redox decarboxylases from quantum chemical calculations

Quantum chemical calculations are today an extremely valuable tool for studying enzymatic reaction mechanisms. In this mini-review, we summarize our recent work on several metal-dependent decarboxylases, where we used the so-called cluster approach to decipher the details of the reaction mechanisms,...

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Detalles Bibliográficos
Publicado en:Comput Struct Biotechnol J
Autores principales: Sheng, Xiang, Himo, Fahmi
Formato: Artigo
Lenguaje:Inglês
Publicado: Research Network of Computational and Structural Biotechnology 2021
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Acceso en línea:https://ncbi.nlm.nih.gov/pmc/articles/PMC8187880/
https://ncbi.nlm.nih.gov/pubmed/34141138
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.csbj.2021.05.044
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