Jeremy C Smith Governor's Chair and Director, UT-ORNL Center for Molecular Biophysics Contact smithjc@ornl.gov | 865.574.9635 All Publications Dynamics of water bound to crystalline cellulose... Modeling of the Passive Permeation of Mercury and Methylmercury Complexes Through a Bacterial Cytoplasmic Membrane... Dynamics at a Peptide–TiO2 Anatase (101) Interface... Protonation-state-Coupled Conformational Dynamics in Reaction Mechanisms of Channel and Pump Rhodopsins... Identification and Structure–Activity Relationships of Novel Compounds that Potentiate the Activities of Antibiotics in Esc... Community detection in sequence similarity networks based on attribute clustering... Dynamical Transition of Collective Motions in Dry Proteins... Community detection in sequence similarity networks based on attribute clustering... Pickin’ Up Good Vibrations... Quasielastic neutron scattering in biology: Theory and applications Modeling of the Passive Permeation of Mercury and Methylmercury Complexes Through a Bacterial Cytoplasmic Membrane Quasielastic neutron scattering in biology: Theory and applications ... The tilt-dependent potential of mean force of a pair of DNA oligomers from all-atom molecular dynamics simulations Structure-based design of broadly protective group a streptococcal M protein-based vaccines... Reviving antibiotics: Efflux pump inhibitors that interact with AcrA, a membrane fusion protein of the AcrAB-TolC multidrug e... Structure-based design of broadly protective group a streptococcal M protein-based vaccines The tilt-dependent potential of mean force of a pair of DNA oligomers from all-atom molecular dynamics simulations... Computationally Identified Novel Chemical Compounds that Antagonize FGF-23... Ensemble-based docking: From hit discovery to metabolism and toxicity predictions... A Distal Disulfide Bridge in OXA-1 β-Lactamase Stabilizes the Catalytic Center and Alters the Dynamics of the Specificity De... Determination of functional collective motions in a protein at atomic resolution using coherent neutron scattering... Neutron structure of human carbonic anhydrase II in complex with methazolamide: mapping the solvent and hydrogen-bonding patt... A Distal Disulfide Bridge in OXA-1 β-Lactamase Stabilizes the Catalytic Center and Alters the Dynamics of the Specificity De... Local Phase Separation of Co-Solvents Enhances Pretreatment of Biomass for Bioenergy Applications... Modeling Mercury in Proteins... Pagination First page « First Previous page ‹‹ … Page 4 Current page 5 Page 6 … Next page ›› Last page Last » Key Links ORCID Organizations Biological and Environmental Systems Science Directorate Biosciences Division