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Molecular Modeling of the Deamidation Reaction in Solution: A Theoretical–Computational Study

[Image: see text] In this work, a theoretical–computational method is applied to study the deamidation reaction, a critical post-translational modification in proteins, using a simple model molecule in solution. The method allows one to comprehensively address the environmental effect, thereby enabl...

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Detalles Bibliográficos
Autores principales: De Sciscio, Maria Laura, Nardi, Alessandro Nicola, Centola, Fabio, Rossi, Mara, Guarnera, Enrico, D’Abramo, Marco
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10641835/
https://www.ncbi.nlm.nih.gov/pubmed/37903302
http://dx.doi.org/10.1021/acs.jpcb.3c04662