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Quantum chemical simulation of the silica-anaesthetic, silica-polymer, and polymer-anaesthetic interactions

Using semiempirical PM3 method, a comparative quantum chemical estimation has been carried out of the energy of articaine adsorption on the surfaces of the following composite materials: silica-anaesthetic, polymer-anaesthetic, and silica-polymer-anaesthetic. It has been found that adsorption on sil...

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Detalles Bibliográficos
Autores principales: Payentko, Victoriya, Kulyk, Tetyana, Kuts, Volodymyr
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer US 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4398688/
https://www.ncbi.nlm.nih.gov/pubmed/25897300
http://dx.doi.org/10.1186/s11671-015-0820-8