Jeremy Smith Governor's Chair and Director, UT-ORNL Center for Molecular Biophysics Contact SMITHJC@ORNL.GOV All Publications Atomistic Simulation of Lignocellulosic Biomass and Associated Cellulosomal Protein Complexes Water Pathways in the Bacteriorhodopsin Proton Pump... Magnesium-Dependent Active-Site Conformational Selection in the Diels-Alderase Ribozyme Probing the mechanism of cellulosome attachment to the Clostridium thermocellum cell surface: computer simulation of the Type... Activity and dynamics of an enzyme, pig liver esterase, in near-anhydrous conditions Understanding enzyme catalysis using computer simulation Mechanism of DNA Recognition by the Restriction Enzyme EcoRV Catalytic Mechanism of Cellulose Degradation by a Cellobiohydrolase, CelS... Paradigm for industrial strain improvement identifies sodium acetate tolerance loci in Zymomonas mobilis and Saccharomyces cerevisiae Peptide partitioning properties from direct insertion studies Structure and Conformational Dynamics of the Metalloregulator MerR upon Binding of Hg(II) A paradigm for strain improvement identifies sodium acetate tolerance loci in Zymomonas mobilis and Saccharomyces cerevisiae Temperature Dependence of Protein Dynamics Simulated With Three Different Water Models Structure and Conformational Dynamics of the Metalloregulator MerR upon Binding of Hg(II) Mechanism and kinetics of peptide partitioning into membranes Theory and Normal Mode Analysis of Change in Protein Vibrational Dynamics on Ligand Binding... Scaling of Multimillion-Atom Biological Molecular Dynamics Simulation on a Petascale Supercomputer... Mechanism of Hg-C Protonolysis in the Organomercurial Lyase MerB Nucleotide-dependence of G-actin conformation from multiple molecular dynamics simulations and observation of a putatively polymerization-competent superclosed state Water molecules in short- and long-distance proton transfer steps of bacteriorhodopsin proton pumping REACH: A Program for Coarse-Grained Biomolecular Simulation Mechanism of a proton pump analyzed with computer simulations... A molecular mechanics force field for lignin Instantaneous Normal Modes and the Protein Glass Transition Instantaneous Normal Modes and the Protein Glass Transition... Pagination First page « First Previous page ‹â¶Ä¹ … Page 10 Current page 11 Page 12 … Next page ›â¶Äº Last page Last » Key Links Organizations Biological and Environmental Systems Science Directorate Biosciences Division
