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MEDT study of the 1,3-DC reaction of diazomethane with Psilostachyin and investigation about the interactions of some pyrazoline derivatives with protease (M(pro)) of nCoV-2

The molecular electronic density theory (MEDT) was invested to elucidate the chemo-, regio- and stereo-selectivity of the 1,3-dipolar cycloaddition between Diazomethane (DZM) and Psilostachyin (PSH). The DFT method at B3LYP/6-31 + G (d,p) level of theory was used. Reactivity indices, transition stru...

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Detalles Bibliográficos
Autores principales:	Salah, M., Belghiti, M.E., Aitouna, A.O., Zeroual, A., Jorio, S., El Alaoui Abdellaoui, H., El Hadki, H., Marakchi, K., Komiha, N.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Elsevier Inc. 2021
Materias:	Topical Perspectives
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7515590/ https://www.ncbi.nlm.nih.gov/pubmed/33069124 http://dx.doi.org/10.1016/j.jmgm.2020.107763

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