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Applications of density functional theory to biological and bioinorganic chemistry

Dennis R. Salahub et al. Recent Progress in Density Functional Methodology for Biomolecular ModelingEugene Serge Kryachko Density Functional Theory and Molecular Interactions: Dispersion InteractionsRadu Silaghi-Dumitrescu Redox Activation of Small Molecules at Biological Metal CentersMauro Causà et...

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Bibliographic Details
Corporate Authors: SpringerLink (Online service)
Group Author: Putz, Mihai V.; Mingos, D. M. P., 1944-
Published:
Literature type: Electronic eBook
Language: English
Series: Structure and bonding, 150
Subjects:
Density functionals.
Chemistry.
Inorganic Chemistry.
Electronic books.
Online Access: http://dx.doi.org/10.1007/978-3-642-32750-6
Summary: Dennis R. Salahub et al. Recent Progress in Density Functional Methodology for Biomolecular ModelingEugene Serge Kryachko Density Functional Theory and Molecular Interactions: Dispersion InteractionsRadu Silaghi-Dumitrescu Redox Activation of Small Molecules at Biological Metal CentersMauro Causà et al. The Bond Analysis Techniques (ELF and Maximum Probability Domains) to a Family of Models Relevant to Bio-Inorganic ChemistryArindam Chakraborty et al. Biological Activity and Toxicity: A Conceptual DFT ApproachMihai V. Putz and Ana-Maria Putz DFT Chemical Reactivity Driven by Biological Activity: Applications for the Toxicological Fate of Chlorinated PAHs
Carrier Form: 1 online resource (xii, 236 p.)
Bibliography: Includes bibliographical references and index.
ISBN: 9783642327506 (electronic bk.)
3642327508 (electronic bk.)
Index Number: QD462
CLC: Q593
Contents: Recent Progress in Density Functional Methodology for Biomolecular Modeling /
Density Functional Theory and Molecular Interactions: Dispersion Interactions /
Redox Activation of Small Molecules at Biological Metal Centers /
The Bond Analysis Techniques (ELF and Maximum Probability Domains) Application to a Family of Models Relevant to Bio-Inorganic Chemistry /
Biological Activity and Toxicity: A Conceptual DFT Approach /
DFT Chemical Reactivity Driven by Biological Activity: Applications for the Toxicological Fate of Chlorinated PAHs /

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