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Assessment of the Role of Computations in Structural Biology Force Fields for Protein Simulations Protein Fields for Protein Simulations Protein Simulation and Drug Design Free Energy Calculations and Ligand Binding Membrane Protein Simulations Large Scale Simulations of Protein Mechanics and Function Structure/Function Correlations of Enzymes using MM QM/MM and Related Approaches Catalysis and Specificity in Enzymes All-atom simulations of protein folding and unfolding
Protein Simulation focuses on predicting how protein will act in vivo. These studies use computer analysis, computer modeling, and statistical probability to predict protein function.
- Force Fields
- Ligand Binding
- Protein Membrane Simulation
- Enzyme Dynamics
- Protein Folding and unfolding simulations
Structural Biologists, Biochemists, Biophysicists, and molecular biologists
- No. of pages:
- © Academic Press 2003
- 10th November 2003
- Academic Press
- Hardcover ISBN:
- eBook ISBN:
University of Washington, Seattle, Washington, U.S.A.