Jeremy C Smith Governor's Chair and Director, UT-ORNL Center for Molecular Biophysics Contact smithjc@ornl.gov | 865.574.9635 All Publications Pathway for Large-Scale Conformational Change in Annexin V... Molecular Dynamics Simulations of the Isolated Domain 1 of Annexin I... Enzyme Dynamics and Activity: Time-Scale Dependence of Dynamical Transitions in Glutamate Dehydrogenase Solution... The Influence of Helix Morphology on Co-operative Polyamide Backbone Conformational Flexibility in Peptide Nucleic Acid Compl... Simulation Analysis of the Retinal Conformational Equilibrium in Dark-Adapted Bacteriorhodopsin... Molecular Dynamics Simulation of the Cyclic Decapeptide Antibiotic, Gramicidin S, in Dimethyl Sulfoxide Solution... Structural Modeling of the Pro-Ocytocin-Neurophysin Precursor... Oxidation of Tetrahydro-Carboline by Cytochrome 450: Determination and Rationalisation of Product Distribution... Nanosecond Protein Dynamics: First Detection of a Neutron Incoherent Spin-Echo Signal... Dynamics of Alkane Chains Included in an Organic Matrix: Molecular Dynamics Simulation and Comparison with Neutron Scattering... Modelling and Simulation of Light-Activated Membrane Proteins: Dynamical Transitions in Bacteriorhodopsin... Enzyme Activity Below the Dynamical Transition at 220 K... All-Atom Empirical Potential for Molecular Modeling and Dynamics Studies of Proteins... Motions in Native and Denatured Proteins... Excluded Volume in the Configurational Distribution of a Strongly-Denatured Protein... X-Ray Diffuse Scattering and Rigid-Body Motion in Crystalline Lysozyme Probed by Molecular Dynamics Simulation... Picosecond Dynamical Changes on Denaturation of Yeast Phosphoglycerate Kinase Revealed by Quasielastic Neutron Scattering... Fuctuation and Correlation in Crystalline Lysozyme... Quantum Chemical and Free Energy Simulation Analysis of Retinal Conformational Energetics... Simulation of Collective Dynamics of n-Nonadecane in the Urea Inclusion Compound... Dynamics of Biomolecules: Simulation Versus X-Ray and Far-Infrared Experiments... Structure of Human Annexin I: Comparison of Homology Modelling and Crystallographic Experiment... Dynamics of Biomolecules: Simulation Versus X-Ray and Far-Infrared Experiments... High-Resolution Vibrational Inelastic Neutron Scattering: A New Spectroscopic Tool for Globular Proteins... Simulation Evidence for Experimentally Detectable Low-Temperature Vibrational Inhomogeneity in a Globular Protein... Pagination First page « First Previous page ‹‹ … Page 15 Current page 16 Page 17 … Next page ›› Last page Last » Key Links ORCID Organizations Biological and Environmental Systems Science Directorate Biosciences Division