Virtual screening of eighteen million compounds against dengue virus: Combined molecular docking and molecular dynamics simulations study

Author:

Mirza Shaher Bano,Salmas Ramin Ekhteiari,Fatmi M. Qaiser,Durdagi Serdar

Publisher

Elsevier BV

Subject

Materials Chemistry,Computer Graphics and Computer-Aided Design,Physical and Theoretical Chemistry,Spectroscopy

Reference52 articles.

1. Identification of potential hit compounds for Dengue virus NS2B/NS3 protease inhibitors by combining virtual screening and binding free energy calculations;Wichapong;Trop. Biomed.,2013

2. Epidemiology of human and animal viral diseases;Murphy;Encycl. Virol.,2008

3. Crystal structure and activity of Kunjin virus NS3 helicase; protease and helicase domain assembly in the full length NS3 protein;Mastrangelo;J. Mol. Biol.,2007

4. Novel benzoxazole inhibitor of dengue virus replication that targets the NS3 helicase;Byrd;Antimicrob. Agents Chemother.,2013

5. Dengue and dengue hemorrhagic fever;Gubler;Clin. Microbiol. Rev.,1998

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