Literature DB >> 7522600

A view of thermodynamics of hydration emerging from continuum studies.

A A Rashin1, M A Bukatin.   

Abstract

Main physical-chemical features of hydration found in continuum studies and possible limitations of the method are analyzed. Particular attention is given to: the choice of thermodynamic observables to be compared to the calculations; representations of the solute polarizability; compensation between the loss of hydration enthalpy and gain in Coulomb interactions upon a complex formation; two minima in interaction potentials between polar groups in solution; similarities and dissimilarities between interaction potentials in solution from continuum and molecular theories; continuum calculations of entropies of hydration; and evaluation of a temperature dependence of thermodynamic characteristics of hydration with continuum methods.

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Year:  1994        PMID: 7522600     DOI: 10.1016/0301-4622(94)00060-3

Source DB:  PubMed          Journal:  Biophys Chem        ISSN: 0301-4622            Impact factor:   2.352


  4 in total

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3.  Toward accurate microscopic calculation of solvation entropies: extending the restraint release approach to studies of solvation effects.

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4.  Sticky ions in biological systems.

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Journal:  Proc Natl Acad Sci U S A       Date:  1995-06-06       Impact factor: 11.205

  4 in total

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