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Solvent Models in Molecular Dynamics Simulations A Brief Overview

Implicit Solvent Models in Molecular Dynamics Simulations A Brief Overview [Pg.125]

An alternative that is becoming more and more popular—the implicit solvent model [1-7]—is based on replacing real water environment consisting of discrete [Pg.125]


Onufriev, A. Implicit solvent models in molecular dynamics simulations a brief overview. In Annual Reports in Computational Chemistry (eds R.A. Wheeler and D.C. Spellmeyer), Vol. 4, Elsevier, Amsterdam, 2008, pp. 125-37. [Pg.70]


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A. Dynamics

Brief

Briefing

Dynamic Simulation Models

Dynamic simulation

Dynamical simulations

In simulations

Model dynamical molecular

Modeling overview

Modeling solvents

Models, overview

Molecular Dynamics Simulation

Molecular dynamic models

Molecular dynamics modeling

Molecular dynamics modelling

Molecular dynamics overview

Molecular dynamics simulation modelling

Molecular dynamics simulation models

Molecular modelling dynamic simulation models

Molecular simulations

Molecular solvent model

Simulant modeling

Simulated model

Simulated modeling

Solvent dynamics

Solvent model

Solvent models model

Solvent molecular

Solvent simulation

Solvents overview

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