Ions and inhibitors in the binding site of HIV protease: comparison of Monte Carlo simulations and the linearized Poisson-Boltzmann theory.

Ions and inhibitors in the binding site of HIV protease: comparison of Monte Carlo simulations and the linearized Poisson-Boltzmann theory. Biophys J. 2009 Feb 18; 96(4):1293-306.

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subject areas

Algorithms
Binding Sites
Catalytic Domain
Computer Simulation
HIV Protease
HIV Protease Inhibitors
Ions
Models, Chemical
Models, Molecular
Monte Carlo Method
Oligopeptides
Protein Binding

authors with profiles

Dirk Gillespie
Bob Eisenberg