Martin Karplus

Name: Martin Karplus
Position: Research Professor in the Department of Chemistry and Chemical Biology
Department: Department of Chemistry & Chemical Biology
Institution: Harvard University, Cambridge
E-mail: marci@tammy.harvard.edu
Homepage: www.chem.harvard.edu/faculty/karplus.html

Fields of interest:
Solution Dynamics and Thermodynamics
Protein and Nucleic Acids

Recent publications:
M. Karplus
Aspects of Protein Reaction Dynamics: Deviations from Simple Behavior
J. Phys. Chem. B 104, 11-27 (2000)

Q. Cui, M. Karplus
Molecular Properties from Combined QM/MM Methods. II. Chemical Shifts in Large Molecules
J. Phys. Chem. B 104, 3721-3743 (2000)

A. R. Dinner, A. Sali, L. J. Smith, C. M. Dobson, M. Karplus
Understanding Protein Folding via Free-Energy Surfaces from Theory and Experiment
TiBS 25, 331-339 (2000)

T. Simonson, G. Archontis, M. Karplus
A Poisson-Boltzmann Study of Charge Insertion in an Enzyme Active Site: The Effect of Dielectric Relaxation
J. Phys. Chem. B 103, 6142-6156 (1999)

Y. Zhou, M. Karplus
Interpreting the Folding Kinetics of Helical Protein
Nature 401, 400-403 (1999)

C. Bartels, M. Karplus
Probability Distributions for Complex Systems: Adaptive Umbrella Sampling of the Potential Energy
J. Phys. Chem. B 102, 865-880 (1998)

G. Archontis, M. Karplus
Cumulant Expansion of the Free Energy: Application to Free Energy Derivatives and Component Analysis
J. Chem. Phys. 105, 11246-11260 (1996)

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