Advances in Quantum Chemistry, Vol. 51

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C P6 F6 v. M3 N36 E59 B Search this Guide Search. Home What's New? Chemical Reaction Rate Constants for Atmospheric Studies — This document contains the latest data on reaction rates and equilibrium constants covering the most important atmospheric chemistry reactions. Haber Volume , 11 , Uchimaru , J.

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Volume 80. Rufus Ritchie, A Gentleman and a Scholar

Nalewajski and R. USA, 97 , Chandra and T. World Scientific, Singapore, Nalewajski , E. Najbar , J. Vanka , T.

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Advances in Quantum Chemistry, Volume 28

Aoki, J. Imamura, B. Aoki, Feng Long Gu , J. Michalak , Two-reactant Fukui function and molecular electrostatic potential analysis of the methyl acrylate binding mode in the complexes with the Ni- and Pd- diimine catalysts , Chem. Szabo , R. Jordan, A.

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Pople Volumene , , Gu , and Y. Kornelak , A. It is the first book offering a comprehensive perspective of the field by examining several different methodological approaches and discussing their applicability and limitations. The book provides the basic knowledge for postgraduate students and researchers in chemistry, biochemistry and biophysics, who want a deeper understanding of complex biological process at the molecular level.

Ruiz-Pernia, V. Moliner, I. Vol Quantum Modeling of Complex Molecular Systems. The chapters contain detailed reviews of the developments of various computational techniques, used to study complex molecular systems such as molecular liquids and solutions particularly aqueous solutions , liquid-gas, solid-gas interphase and biomacromolecular systems. Quantum modeling of complex molecular systems is a useful resource for graduate students and fledgling researchers and is also an excellent companion for research professionals engaged in computational chemistry, material science, nanotechnology, physics, drug design, and molecular biochemistry.

Ferrer, J. Ruiz-Pernia, S.

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Bertran and J. Christov Ed. This volume features articles on Computational Chemistry methods in Structural Biology.

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Ferrer, S. Moliner e I. Paneth and A. Dybala-Defratyka Eds. Then it examines studies of systems of increasing complexity up to the dynamics of DNA.