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Decrypting Strong and Weak Single-Walled Carbon Nanotubes Interactions with Mitochondrial Voltage-Dependent Anion Channels Using Molecular Docking and Perturbation Theory

The current molecular docking study provided the Free Energy of Binding (FEB) for the interaction (nanotoxicity) between VDAC mitochondrial channels of three species (VDAC1-Mus musculus, VDAC1-Homo sapiens, VDAC2-Danio rerio) with SWCNT-H, SWCNT-OH, SWCNT-COOH carbon nanotubes. The general results s...

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Detalles Bibliográficos
Autores principales: González-Durruthy, Michael, Werhli, Adriano V., Seus, Vinicius, Machado, Karina S., Pazos, Alejandro, Munteanu, Cristian R., González-Díaz, Humberto, Monserrat, José M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5643473/
https://www.ncbi.nlm.nih.gov/pubmed/29038520
http://dx.doi.org/10.1038/s41598-017-13691-8