40181

applications to simulations of biomolecules

Feig, Michael.

Weinheim Wiley-VCH

Modeling solvent environments : applications to simulations of biomolecules

Includes bibliographical references and index.

Biomolecular solvation in theory and experiment -- Model-free "solvent modeling" in chemistry and biochemistry based on the statistical mechanics of liquids -- Developing force fields from the microscopic structure of solutions: the Kirkwood-Buff approach -- Osmolyte influence on protein stability: perspectives of theory and experiment -- Modeling aqueous solvent effects through local properties of water -- Continuum electrostatics solvent modeling with the generalized Born model -- Implicit solvent force-field optimization -- Modeling protein solubility in implicit solvent -- Fast analytical continuum treatments of solvation -- On the development of state-specific coarse-grained potentials of water -- Molecular dynamics simulations of biomolecules in a polarizable coarse-grained solvent -- Modeling electrostatic polarization in biological solvents.

TP

247.5

.M64

2010

دانشگاه پيام نورمشهد

1393/02/03

انگليسي

9783527324217 (alk. paper)

Weinheim : Wiley-VCH, c2010.