Locking the 150-cavity open : in silico design and verification of influenza neuraminidase inhibitors

• Main Authors: Han, Nanyu, Mu, Yuguang
• Other Authors: School of Biological Sciences
• Format: Article
• Language: English
• Published: 2013
• Subjects: DRNTU::Science::Biological sciences::Microbiology
• Online Access: https://hdl.handle.net/10356/103809; http://hdl.handle.net/10220/16533
• Institution: Nanyang Technological University

Neuraminidase (NA) of influenza is a key target for virus infection control and the recently discovered open 150-cavity in group-1 NA provides new opportunity for novel inhibitors design. In this study, we used a combination of theoretical methods including fragment docking, molecular linking and mo...