Multiscale Simulations and Molecular Dynamics

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Many important material processes occur over time and length scales that are inaccessible to atomistic simulations alone. Multiscale simulations provide a way to bridge this gap. Our lab uses molecular dynamics and multiscale modeling to study macromolecular systems over extended scales. We carefully connect detailed molecular interactions to larger-scale behavior. This approach allows us to capture realistic dynamics while maintaining physical fidelity. It is a core capability that supports nearly all of our research efforts.