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methods and systems to overcome the limitations of today’s materials processing technologies. One particular area of interest is the design and fabrication of active structures through hybrid production
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for structural analysis of metabolites and lipids, creating metabolomics knowledge graphs, and inferring fluxes from MS data. The group collaborates with mass spectrometry vendors and technology partners
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vibrations), and structural (migration of atoms) effects with an atomistic resolution. This can be achieved by self-consistently coupling molecular dynamics (MD), density-functional theory (DFT), and quantum
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