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Atomistic mapping - PowerPoint PPT Presentation

Coarse grained to atomistic mapping algorithm A tool for multiscale simulations

Coarse grained to atomistic mapping algorithm A tool for multiscale simulations. Steven O. Nielsen Department of Chemistry University of Texas at Dallas. Outline. Role of inverse mapping in Multiscale simulations Validation of coarse grained (CG) models CG force field development

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Atomistic mapping - PowerPoint PPT Presentation

Coarse grained to atomistic mapping algorithm A tool for multiscale simulations