Structural Investigation of Beta-Cyclodextrin Complexes with Cannabidiol and Delta-9-Tetrahydrocannabinol in 1:1 and 2:1 Host-Guest Stoichiometry: Molecular Docking and Density Functional Calculations

The complexation of β-cyclodextrin (β-CD) with cannabidiol (CBD) and Δ(9)-tetrahydrocannabinol (THC) was investigated using molecular docking and M062X/6-31G(d,p) calculations. The calculations suggested two possible complex formations of 1:1 and 2:1 host-guest molecular ratio of β-CD with CBD and T...

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Detalles Bibliográficos
Autores principales: Triamchaisri, Nat, Toochinda, Pisanu, Lawtrakul, Luckhana
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9865391/
https://www.ncbi.nlm.nih.gov/pubmed/36675035
http://dx.doi.org/10.3390/ijms24021525

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9865391/
https://www.ncbi.nlm.nih.gov/pubmed/36675035
http://dx.doi.org/10.3390/ijms24021525

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