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on "Canalization and Other Design Principles of Gene Regulatory Network Models" (https://www.nsf.gov/awardsearch/showAward?AWD_ID=2451973 ) and "A mathematical theory for the biological concept of modularity” (https
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the design of selective ligands, and support experimental validation efforts. Specific responsibilities include: Performing conformational sampling and binding free energy estimation of peptide–metal complexes
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