Physics – Condensed Matter – Statistical Mechanics
Scientific paper
2002-01-15
Physical Review E 64, 051805 (2001)
Physics
Condensed Matter
Statistical Mechanics
REVTeX, 6 pages, 3 figures
Scientific paper
10.1103/PhysRevE.64.051805
We introduce an exactly solvable statistical-mechanical model of the hydration of non-polar compounds, based on grouping water molecules in clusters where hydrogen bonds and isotropic interactions occur; interactions between clusters are neglected. Analytical results show that an effective strengthening of hydrogen bonds in the presence of the solute, together with a geometric reorganization of water molecules, are enough to yield hydrophobic behavior. We extend our model to describe a non-polar homopolymer in aqueous solution, obtaining a clear evidence of both ``cold'' and ``warm'' swelling transitions. This suggests that our model could be relevant to describe some features of protein folding.
Bruscolini Pierpaolo
Casetti Lapo
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