Reviews in Computational Chemistry, Volume 19 ( Reviews in Computational Chemistry )

Publication series ：Reviews in Computational Chemistry

Author： Kenny B. Lipkowitz  

Publisher： John Wiley & Sons Inc‎

Publication year： 2003

E-ISBN: 9780471466642

P-ISBN(Hardback):  9780471235859

Subject： O6-04 chemical calculation, statistics chemical

Language： ENG

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Description

The Reviews in Computational Chemistry series brings together leading authorities in the field. The chapters in this book series are written to teach the newcomer and update the expert. Topics include computational chemistry, molecular modeling, computer-assisted molecular design (CAMD), quantum chemistry, molecular mechanics and dynamics, and quantitative structure-activity relationships (QSAR).

  • Detailed author and subject indices on each volume help the reader to quickly discover particular topics.
  • The chapters are approached in a tutorial manner and written in a non-mathematical style allowing students and researchers to access computational methods outside their immediate area of expertise.

Chapter

Contents

pp.：  1 – 11

1. Computational Techniques and Strategies for Monte Carlo Thermodynamic Calculations, with Applications to Nanoclusters

pp.：  11 – 27

2. Computing Hydrophobicity

pp.：  27 – 69

3. Born–Oppenheimer Direct Dynamics Classical Trajectory Simulations

pp.：  69 – 105

4. The Poisson–Boltzmann Equation

pp.：  105 – 173

Author Index

pp.：  173 – 393

Subject Index

pp.：  393 – 409

LastPages

pp.：  409 – 419

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