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Development and benchmark to obtain AMBER parameters dataset for non-standard amino acids modified with 4-hydroxy-2-nonenal

The data described here support the research article “4-HNE carbonylation induces local conformational changes on bovine serum albumin and thioredoxin. A molecular dynamics study” (Alviz-Amador et al., 2018) . Dataset on Gaff force field parameters of AMBER is provided for assembled three non-standa...

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Detalles Bibliográficos
Autores principales:	Alviz-Amador, Antistio, Galindo-Murillo, Rodrigo, Pineda-Alemán, Rafael, Pérez-González, Humberto, Rodríguez-Cavallo, Erika, Vivas-Reyes, Ricardo, Méndez-Cuadro, Darío
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Elsevier 2018
Materias:	Biochemistry, Genetics and Molecular Biology
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6288414/ https://www.ncbi.nlm.nih.gov/pubmed/30761340 http://dx.doi.org/10.1016/j.dib.2018.11.102

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