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The Motion Paradigm of Pre-Dock Zearalenone Hydrolase Predictions with Molecular Dynamics and the Docking Phase with Umbrella Sampling

Zearalenone (ZEN) is one of the most prevalent estrogenic mycotoxins, is produced mainly by the Fusarium family of fungi, and poses a risk to the health of animals. Zearalenone hydrolase (ZHD) is an important enzyme capable of degrading ZEN into a non-toxic compound. Although previous research has i...

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Detalles Bibliográficos
Autores principales: Hong, Xi-Zhi, Han, Zheng-Gang, Yang, Jiang-Ke, Liu, Yi-Han
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10254720/
https://www.ncbi.nlm.nih.gov/pubmed/37299021
http://dx.doi.org/10.3390/molecules28114545

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