Determination of the effective dielectri
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Vladislav Vasilyev
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Article
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2002
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John Wiley and Sons
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English
β 280 KB
Constant dielectric (CD) and distance-dependent dielectric (DDD) functions are the most popular and widespread in the Molecular Mechanics simulations of large molecular systems. In this article, we present a simple procedure to derive an effective dielectric constant, epsilon (out,eff), for these tw