Selected Publications - Tom Keyes
- Jae Gil Kim and T. Keyes, Inherent Structure Thermodynamics of Protein Folding, J. Phys. Chem. B, submitted (2006).
P. Mankoo and T. Keyes, Classical Molecular Electrostatics: Binding of Ligands to Proteins and the Vibrational Stark Effect, J. Phys. Chem. B, in press (2006).
Jae Gil Kim, J. E. Straub and T. Keyes, Statistical Temperature Monte Carlo and Molecular Dynamics Algorithms, Phys. Rev. Lett. 97, 050601 (2006).
R. DeVane, C. Kasprzyk, B. Space and T. Keyes, A Theoretical Investigation of the Temperature Dependence of the Fifth Order Raman Response Function of Liquid Xenon, J. Phys. Chem. B 110, 3773 (2006).
T. Keyes, The Relation Between Unstable Instantaneous Normal Modes and Diffusion, a chapter in 'Normal Mode Analysis: Theory and Applications to Biological and Chemical Systems', CRC Press (2006).
J. Kim and T. Keyes, Qualitative Features of the Two-Dimensional Intermolecular Raman Spectrum in Liquids, J. Chem. Phys. 122, 244502 (2005).
R. DeVane, Christina Ridley, Brian Space and T. Keyes, Tractable Theory of Nonlinear Response and Multidimensional Nonlinear Spectroscopy, Phys. Rev. E 70, 050101 (2004).
J. Chowdhary and T. Keyes, Thermodynamics and Dynamics in a Model Potential Energy Landscape, J. Phys. Chem. B 108, 19786 (2004).
R. De Vane, C. Ridley, B. Space and T. Keyes, The Time Correlation Function Theory for Nonlinear Spectra: Two-Dimensional IR, J. Chem. Phys. 121, 3688 (2004).
J. Kim and T. Keyes, On The Mechanism of Reorientational and Structural Relaxation in Supercooled Liquids: the Role of Border Dynamics and Cooperativity, J. Chem. Phys. 121, 4237 (2004).