Applications of Density Functional Theory to Biological and Bioinorganic Chemistry [electronic resource] / edited by Mihai V. Putz, D. Michael P. Mingos.
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Dennis R. Salahub et al.��������� Recent Progress in Density Functional Methodology for Biomolecular Modeling Eugene Serge Kryachko��������� Density Functional Theory and Molecular Interactions: Dispersion Interactions Radu Silaghi-Dumitrescu������� Redox Activation of Small Molecules at Biological Metal Centers Mauro Caus� et al.���� The Bond Analysis Techniques (ELF and Maximum Probability Domains) to a Family of Models Relevant to Bio-Inorganic Chemistry Arindam Chakraborty et al.������� Biological Activity and Toxicity: A Conceptual DFT Approach Mihai V. Putz and Ana-Maria Putz���� DFT Chemical Reactivity Driven by Biological Activity: Applications for the Toxicological Fate of Chlorinated PAHs.
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