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Xiongwu Wu


Xiongwu Wu

National Institutes of Health Bethesda, USA

Biography

Xiongwu Wu has his expertise in molecular simulation and method development. He developed Self-Guided Molecular/Langevin Dynamics simulation (SGMD/SGLD) methods that enable molecular simulation to access long-time scale events. He has developed core-weighted grid-threading method for rigid fitting of proteins into low resolution cryo-EM maps and Map-restrained SGLD (MapSGLD) method to flexible fit protein structures into cryo-EM maps. He is also the developer for both molecular simulation and modeling packages AMBER and CHARMM

Abstract

Abstract : New Structure And Energy Cycles Of Kinesin Dimers Walking On Microtubules Revealed From Molecular Simulations