00885cam0 22002531 450 SOBE0004626820150309114516.020150309d2015 |||||ita|0103 baitaITImposta sul valore aggiuntoD.P.R. n. 633/1972, D.L. n. 331/1993 ...Milanofiori AssagoIpsoa Gruppo Wolters Kluwer2015320 p.18 cmTascabili del Corriere tributario001SOBE000425492001 *Tascabili del Corriere tributarioITUNISOB20150309RICAUNISOBUNISOB340165528SOBE00046268M 102 Monografia moderna SBNM340007810SI16552820150224omaggiocatenacciUNISOBUNISOB20150309114607.020150309114726.0catenacciImposta sul valore aggiunto178646UNISOB03491nam 22005175 450 991043782060332120251116210537.03-642-32750-810.1007/978-3-642-32750-6(CKB)3360000000455781(SSID)ssj0000878464(PQKBManifestationID)11548276(PQKBTitleCode)TC0000878464(PQKBWorkID)10835998(PQKB)10984498(DE-He213)978-3-642-32750-6(MiAaPQ)EBC3107091(PPN)168322633(EXLCZ)99336000000045578120130202d2013 u| 0engurnn#008mamaatxtccrApplications of Density Functional Theory to Biological and Bioinorganic Chemistry /edited by Mihai V. Putz, D Michael P Mingos1st ed. 2013.Berlin, Heidelberg :Springer Berlin Heidelberg :Imprint: Springer,2013.1 online resource (XII, 236 p. 107 illus., 41 illus. in color.)Structure and Bonding,0081-5993 ;150Includes bibliographical references and index.3-642-32749-4 Recent progress in density functional methodology for biomolecular modeling / Dennis R. Salahub, Aurélien de la Lande, Annick Goursot, Rui Zhang, and Yue Zhang -- Density functional theory and molecular interactions: dispersion interactions / Eugene S. Kryachko -- Redox activation of small molecules at biological metal centers / Radu Silaghi-Dumitrescu -- The bond analysis techniques (ELF and maximum probability domains) application to a family of models relevant to bio-inorganic chemistry / Mauro Causà, Maddalena D'Amore, Carmine Garzillo, Franceso Gentile, and Andreas Savin -- Biological activity and toxicity: a conceptual DFT approach / Arindam Chakraborty, Sudip Pan, and Pratim K. Chattaraj -- DFT chemical reactivity driven by biological activity: applications for the toxicological fate of chlorinated PAHs / Mihai V. Putz, Ana-Maria Putz.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.Structure and Bonding,0081-5993 ;150Chemistry, InorganicInorganic Chemistryhttps://scigraph.springernature.com/ontologies/product-market-codes/C16008Chemistry, Inorganic.Inorganic Chemistry.546Putz Mihai V.edthttp://id.loc.gov/vocabulary/relators/edtMingos D. M. P.1944-edthttp://id.loc.gov/vocabulary/relators/edtBOOK9910437820603321Applications of Density Functional Theory to Biological and Bioinorganic Chemistry2532095UNINA