Theoretical Study of Adenine to Guanine Transition Assisted by Water and Formic Acid Using Steered Molecular Dynamic Simulations

The free energy profile of the adenine to guanine transition in the gas and aqueous phases was obtained by applying steered molecular dynamic (SMD) simulations. Three processes were considered to explain the mechanism assisted by water and formic acid molecules. The first process is hydrolytic deami...

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Detalles Bibliográficos
Autores principales: Tolosa, Santiago, Sansón, Jorge A., Hidalgo, Antonio
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2019
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6582222/
https://www.ncbi.nlm.nih.gov/pubmed/31249828
http://dx.doi.org/10.3389/fchem.2019.00414

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6582222/
https://www.ncbi.nlm.nih.gov/pubmed/31249828
http://dx.doi.org/10.3389/fchem.2019.00414

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