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QSAR, ADME-Tox, molecular docking and molecular dynamics simulations of novel selective glycine transporter type 1 inhibitors with memory enhancing properties

A structural class of forty glycine transporter type 1 (GlyT1) inhibitors, was examined using molecular modeling techniques. The quantitative structure-activity relationships (QSAR) technology confirmed that human GlyT1 activity is strongly and significantly affected by constitutional, geometrical,...

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Detalles Bibliográficos
Autores principales:	El fadili, Mohamed, Er-rajy, Mohammed, Imtara, Hamada, Noman, Omar M., Mothana, Ramzi A., Abdullah, Sheaf, Zerougui, Sara, Elhallaoui, Menana
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Elsevier 2023
Materias:	Research Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9971180/ https://www.ncbi.nlm.nih.gov/pubmed/36865465 http://dx.doi.org/10.1016/j.heliyon.2023.e13706

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