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Journal of Chemical Theory and Computation|November 24, 2015
Routine Microsecond Molecular Dynamics Simulations with AMBER on GPUs. 2. Explicit Solvent Particle Mesh EwaldRomelia Salomon-Ferrer, Andreas W Götz, Duncan Poole, et al.Journal of Chemical Theory and Computation|May 15, 2012
Routine Microsecond Molecular Dynamics Simulations with AMBER on GPUs. 1. Generalized BornAndreas W Götz, Mark J Williamson, Dong Xu, et al.Arxiv|July 18, 2020
GPU-Accelerated Drug Discovery with Docking on the Summit Supercomputer: Porting, Optimization, and Application to COVID-19 ResearchScott LeGrand, Aaron Scheinberg, Andreas F Tillack, et al.Pageof 1