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Recent Advances in the Understanding of Hydrophobic and Hydrophilic Effects: A Theoretical and Computer Simulation Perspective

  • Ricardo L. Mancera
  • Michalis Chalaris
  • Jannis Samios
Chapter
Part of the NATO Science Series book series (NAII, volume 133)

Abstract

The study of solvation phenomena is fundamental to the local microscopic structure and dynamics of liquids and aqueous solutions and the chemical reactions that take place in them. Here we review some of the recent theoretical and computer simulation advances in the study of hydrophobic effects in small relatively simple non-polar molecules in aqueous solution. We also summarize recent efforts in understanding aqueous DMSO solutions as a system where both hydrophobic and hydrophilic effects seem to be present.

Key words

Hydrophobic hydrophilic DMSO water aqueous solution computer simulation 

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Copyright information

© Springer Science+Business Media Dordrecht 2004

Authors and Affiliations

  • Ricardo L. Mancera
    • 1
  • Michalis Chalaris
    • 2
  • Jannis Samios
    • 2
  1. 1.Compass HouseDe Novo Pharmaceuticals Ltd.CambridgeUK
  2. 2.Laboratory of Physical Chemistry, Department of ChemistryUniversity of AthensAthensGreece

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