Computer-aided design of novel HIV-1 entry inhibitors blocking the virus envelope gp120 V3 loop

• Published in: Вiopolymers and Cell
• Date: 2012
• Main Authors: Andrianov, A.M., Anishchenko, I.V., Kisel, M.A., Kornoushenko, Yu.V., Nikolayevich, V.A., Eremin, V.F., Kucherov, I.I., Tuzikov, A.V.
• Format: Article
• Language: English
• Published: Інститут молекулярної біології і генетики НАН України 2012
• Subjects: Bioorganic Chemistry
• Online Access: https://nasplib.isofts.kiev.ua/handle/123456789/156854
• Journal Title: Digital Library of Periodicals of National Academy of Sciences of Ukraine
• Cite this: Computer-aided design of novel HIV-1 entry inhibitors blocking the virus envelope gp120 V3 loop / A.M. Andrianov, I.V. Anishchenko, M.A. Kisel, Yu.V. Kornoushenko, V.A. Nikolayevich, V.F. Eremin, I.I. Kucherov, A.V. Tuzikov // Вiopolymers and Cell. — 2012. — Т. 28, № 6. — С. 468-476. — Бібліогр.: 37 назв. — англ.

Aim. The object of this study was to implement computer-aided design of the water-soluble analog of glycolipid β -galactosylceramide (β-GalCer), which presents a potential HIV-1 entry inhibitor, by the analysis of intermolecular interactions of β-GalCer with the central region of the virus envelope...