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Computational Design of Radical Recognition Assay with the Possible Application of Cyclopropyl Vinyl Sulfides as Tunable Sensors

The processes involving the capture of free radicals were explored by performing DFT molecular dynamics simulations and modeling of reaction energy profiles. We describe the idea of a radical recognition assay, where not only the presence of a radical but also the nature/reactivity of a radical may...

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Detalles Bibliográficos
Autores principales: Sahharova, Liliya T., Gordeev, Evgeniy G., Eremin, Dmitry B., Ananikov, Valentine P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8306039/
https://www.ncbi.nlm.nih.gov/pubmed/34299255
http://dx.doi.org/10.3390/ijms22147637