Applications of Density Functional Theory to Biological and Bioinorganic Chemistry

• Corporate Author: SpringerLink (Online service)
• Other Authors: Putz, Mihai V. (Editor), Mingos, D. Michael P. (Editor)
• Format: Electronic eBook
• Language: English
• Published: Berlin, Heidelberg : Springer Berlin Heidelberg : Imprint: Springer, 2013.
• Series: Structure and Bonding, 150
• Subjects: Chemistry.; Inorganic chemistry.; Inorganic Chemistry.
• Physical Description: XII, 236 p. 107 illus., 41 illus. in color. online resource.
• ISBN: 9783642327506
• ISSN: 0081-5993 ;

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 Causà 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.