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QM/MM Molecular Dynamics Simulations Revealed Catalytic Mechanism of Urease
[Image: see text] Urease catalyzes the hydrolysis of urea to form ammonia and carbamate, inducing an overall pH increase that affects both human health and agriculture. Inhibition, mutagenesis, and kinetic studies have provided insights into its enzymatic role, but there have been debates on the sub...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2022
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8935366/ https://www.ncbi.nlm.nih.gov/pubmed/35238572 http://dx.doi.org/10.1021/acs.jpcb.1c10200 |