Uncovering the Molecular Basis for the Better Gefitinib Sensitivity of EGFR with Complex Mutations over Single Rare Mutation: Insights from Molecular Simulations
Article in Molecules (June 2022)
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Insights into the negative regulation of EGFR upon the binding of an allosteric inhibitor
Article in Chemical Biology & Drug Design (February 2022)
Simulated Drug Efflux for the AbgT Family of Membrane Transporters
Article in Journal of Chemical Information and Modeling (October 2021)