Induced fit, ensemble binding space docking and Monte Carlo simulations of MDMA ‘ecstasy’ and 3D pharmacophore design of MDMA derivatives on the human serotonin transporter (hSERT)

The popular recreational drug MDMA (3,4-methylenedioxy-methamphetamine) has a documented potential as a psychopharmacological clinical and research tool. This is due to its unique ability to promote reprocessing of traumatic memories, empathetic and pro-social states. Although it is established that...

Descripción completa

Detalles Bibliográficos
Autores principales: Islas, Ángel A., Moreno, Laura G., Scior, Thomas
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2021
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8379675/
https://www.ncbi.nlm.nih.gov/pubmed/34458620
http://dx.doi.org/10.1016/j.heliyon.2021.e07784

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8379675/
https://www.ncbi.nlm.nih.gov/pubmed/34458620
http://dx.doi.org/10.1016/j.heliyon.2021.e07784

Ejemplares similares