Join us for an exclusive webinar as we present an enhanced sampling strategy for exploring molecular behavior.
Join us for an exclusive webinar as we present an enhanced sampling strategy for exploring molecular behavior. Discover what Gaussian accelerated molecular dynamics (GaMD) is and how this method can be used to gain insights into the dynamics of small and biological molecules. Dr. Reed Harrison will introduce new methods implemented in BIOVIA Discovery Studio Simulation including GaMD Equilibration, GaMD Production, and Estimate Free Energy Landscape. He will cover how to set up and run GaMD with GaMD Equilibration and GaMD Production, as well as how to analyze simulation results with Estimate Free Energy Landscape. These methods can be applied to a variety of biological systems, and Reed will demonstrate applications of the workflow to sampling loop conformations from antibody complementarity-determining regions and peptide folding.
Webinar Highlights:
