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Prediction of the binding mode between BMS-378806 and HIV-1 gp120 by docking and molecular dynamics simulation

✍ Scribed by Ren Kong; Jian Jun Tan; Xiao Hui Ma; Wei Zu Chen; Cun Xin Wang


Publisher
Elsevier Science
Year
2006
Tongue
English
Weight
453 KB
Volume
1764
Category
Article
ISSN
1570-9639

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## Abstract Human immunodeficiency virus type 1 integrase (IN) is an essential enzyme in the life cycle of this virus and also an important target for the study of anti‐HIV drugs. In this work, the binding modes of the wild type IN core domain and the two mutants, that is, W132G and C130S, with the