intermolecular interactions: from diatomics to biopolymers: edited by bernard pullman, john wiley...
TRANSCRIPT
356
Intermolecular Interactions: From Diatomics to Biopolymers, edited by
Bernard Pullman, John Wiley & Sons, Chichester, New York, Brisbane, Toronto,
1978, pp ix + 447, price 519-50.
This book is the second volume in the series: Perspectives in Quantum
Chemistry and Biochemistry, the aim of which is to provide an interdisciplin-
ary survey of recent developments in selected fields. The first volume
dealt with the study of intramolecular interactions - quantum mechanics of
molecular conformations, and this volume extends the subject to intermolecu-
lar interactions. The book comprises four reviews which illustrate the
achievements and possibilities of quantum mechanical techniques in this
field.
In Chapter 1, A.D. Buckingham reviews the theory of intermolecular
forces, and describes the dependence of the energy on the separation and
orientations of the molecules. Sections cover classification, long- and
short-range forces, the hydrogen bond and donor-acceptor interactions, the
effect of a medium, particular molecular interactions, and manifestations of
intermolecular forces. The second review, by P Claverie, covers elaboration
of approximate formulas for the interactions between large molecules and
applications in organic chemistry. Basic theory necessary for the derivation
of simplified formulae is given, the Rayleigh-SchrBdinger perturbation
treatment is analysed and treatments to overcome its deficiency are examined.
The derivation of the short-range first-order exchange term and three long-
range terms (electrostatic, polarisation and dispersion) is dealt with in
detail. Some applications of simplified formulas are also discussed. The
third chapter, by R Rein, deals with theoretical and experimental studies of
intermolecular interactions between nucleic acid components and their struc-
tural consequences. There is a brief review of the quantum mechanical analy-
sis of hydrogen bonding and a discussion of the methods for studying inter-
molecular interactions in large systems. Experimental results on interac-
tions of nucleic acid bases are discussed and environmental effects are
reviewed. Application to the analysis of genetic mechanisms, and the valid-
ity of the theoretical model, are also dealt with. Finally, P Schuster,
reviews the fine structure of the hydrogen bond. Initially he discusses the
present stage of quantum mechanical predictions of molecular properties.
Further sections deal with energies and wave functions of hydrogen bonded
complexes and crystals, the usefulness of energy partitioning, and possible
developments in the near future.
J.W.