Promising Aedes aegypti Repellent Chemotypes Identified through Integrated QSAR, Virtual Screening, Synthesis, and Bioassay

Molecular field topology analysis, scaffold hopping, and molecular docking were used as complementary computational tools for the design of repellents for Aedes aegypti, the insect vector for yellow fever, chikungunya, and dengue fever. A large number of analogues were evaluated by virtual screening...

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Detalles Bibliográficos
Autores principales: Oliferenko, Polina V., Oliferenko, Alexander A., Poda, Gennadiy I., Osolodkin, Dmitry I., Pillai, Girinath G., Bernier, Ulrich R., Tsikolia, Maia, Agramonte, Natasha M., Clark, Gary G., Linthicum, Kenneth J., Katritzky, Alan R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2013
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3765160/
https://www.ncbi.nlm.nih.gov/pubmed/24039693
http://dx.doi.org/10.1371/journal.pone.0064547

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3765160/
https://www.ncbi.nlm.nih.gov/pubmed/24039693
http://dx.doi.org/10.1371/journal.pone.0064547

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