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Molecular Modeling and Dynamics of Bioinorganic Systems - Tetsuya Watanabe
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Molecular Modeling and Dynamics of Bioinorganic Systems - nouveau livre

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A unique selection of papers on the most recent progress in the modelling of biological molecules containing metal ions. New approaches and techniques in this field are allowing resear… Plus…

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A unique selection of papers on the most recent progress in the modelling of biological molecules containing metal ions. New approaches and techniques in this field are allowing researche… Plus…

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Molecular Modeling and Dynamics of Bioinorganic Systems - Lucia Banci; Peter Comba
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Molecular Modeling and Dynamics of Bioinorganic Systems - nouveau livre

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Chemistry; Inorganic Chemistry; Computer Applications in Chemistry; Theoretical and Computational Chemistry Nucleotide, enzyme, enzymes, protein, proteins Books eBook, Springer Science+Bu… Plus…

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Molecular Modeling and Dynamics of Bioinorganic Systems - nouveau livre

ISBN: 9789401151719

Proceedings of the NATO Advanced Research Workshop on Molecular Modeling and Dynamics of Biological Molecules containing Metal Ions, San Miniato (Pisa), Italy, March 15-21, 1997 SCIENCE,C… Plus…

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EAN (ISBN-13): 9789401151719
Editeur: World Scientific Publishing Company

Livre dans la base de données depuis 2017-06-15T04:04:03+02:00 (Zurich)
Page de détail modifiée en dernier sur 2023-09-27T13:01:25+02:00 (Zurich)
ISBN/EAN: 9789401151719

ISBN - Autres types d'écriture:
978-94-011-5171-9
Autres types d'écriture et termes associés:
Auteur du livre: watanabe


Données de l'éditeur

Auteur: Lucia Banci; Peter Comba
Titre: NATO Science Partnership Sub-Series: 3; Molecular Modeling and Dynamics of Bioinorganic Systems - High Technology (Continued Within NATO Science Series II: Mathematics, Physics and Chemistry)
Editeur: Springer; Springer Netherland
470 Pages
Date de parution: 2012-12-06
Dordrecht; NL
Langue: Anglais
213,99 € (DE)
220,00 € (AT)
236,00 CHF (CH)
Available
XIII, 470 p.

EA; E107; eBook; Nonbooks, PBS / Chemie/Anorganische Chemie; Anorganische Chemie; Verstehen; Nucleotide; enzyme; enzymes; protein; proteins; B; Inorganic Chemistry; Computational Chemistry; Theoretical Chemistry; Chemistry and Materials Science; Chemoinformatik; Quanten- und theoretische Chemie; BC

1 Solution Structures of Proteins Containing Paramagnetic Metal Ions.- 2 Modeling of Structures and Molecular Properties of Transition Metal Compounds — Toward Metalloprotein Modeling.- 3 Extending Molecular Mechanics Methods to the Descriptions of Transition Metal Complexes and Bond-Making and -Breaking Processes.- 4 A Novel Molecular Mechanics Strategy for Transition Metals Bound to Biological Molecules.- 5 Computational Analysis of Inorganic and Bio-Inorganic Nickel Complexes.- 6 Molecular Modeling of Platinum Complexes with Oligonucleotides: Methodological Lessons and Structural Insights.- 7 Metal Cations in Biological Systems: Modeling Metal Ions in lonophores and DNA.- 8 The Role of Ca2+ in the Binding of Carbohydrates to C-Type Lectins as Revealed by Molecular Mechanics and Molecular Dynamics Calculations.- 9 Molecular Dynamics Calculations on Metalloproteins.- 10 The Effective Crystal Field Methodolgy as Used to Incorporate Transition Metals Into Molecular Mechanics.- 11 Quantum Chemical Studies of Transition Metal Catalyzed Enzyme Reactions.- 12 Ab Initio and Desity Functional Theory Applied to Models for the Oxo Transfer Reaction of Dioxomolybdenum Enzymes.- 13 Quantum Mechanical Modeling of Active Sites in Metalloproteins. Electrostatic Coupling to the Protein/Solvent Environment.- 14 Semi-empirical MO Calculations on Enzyme Reaction Mechanisms.- 15 Normal Mode Analysis of Proteins to Interpret Resonant and Inelastic Scattering of ? Quanta.- 16 Computer Simulations of the Action of Metalloenzymes.- 17 The Role of the Protein in Modulating Cofactor Electrochemistry in Proteins: The Calculation of Electrostatic Forces.- 18 Molecular Dynamics Study of H93G Sperm Whale Deoxymyoglobin Mutants with Exogenous Proximal Ligands.- 19 The Role of Electrostatics atthe Catalytic Metal Binding Site in Xylose Isomerase Action.- 20 Copper(II) and Zinc(lI) Complexes of Peptides as Models for Collagenase Inhibitors.

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