BiophysicsJournal of Chemical Information and ModelingPeer-reviewed
Synergistic Effects of pH and Temperature on Dengue VirusEnvelope Dimers: Insights from Microsecond MolecularDynamics Simulations
Georcki Ropón‐Palacios, Luís Gustavo Fávaro Crespi, Ingrid B. S. Martins…·Alexandre Suman de Araújo
This study uses molecular dynamics simulations to show how pH and temperature together destabilize dengue virus envelope dimers, revealing a 'compensatory embrace' mechanism and potential targets for antiviral drugs.
DOI 10.1021/acs.jcim.6c01334