Fluctuations of Water near Extended Hydrophobic and Hydrophilic Surfaces
نویسندگان
چکیده
منابع مشابه
Fluctuations of water near extended hydrophobic and hydrophilic surfaces.
We use molecular dynamics simulations of the SPC-E model of liquid water to derive probability distributions for water density fluctuations in probe volumes of different shapes and sizes, both in the bulk as well as near hydrophobic and hydrophilic surfaces. Our results are obtained with a biased sampling of coarse-grained densities that is easily combined with molecular dynamics integration al...
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ژورنال
عنوان ژورنال: The Journal of Physical Chemistry B
سال: 2010
ISSN: 1520-6106,1520-5207
DOI: 10.1021/jp909048f