Classical And Quantum Dynamics In Condensed Phase Simulations: Proceedings Of The International School Of Physics

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Publisher : World Scientific
ISBN 13 : 9814496057
Total Pages : 881 pages
Book Rating : 4.8/5 (144 download)

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Book Synopsis Classical And Quantum Dynamics In Condensed Phase Simulations: Proceedings Of The International School Of Physics by : Bruce J Berne

Download or read book Classical And Quantum Dynamics In Condensed Phase Simulations: Proceedings Of The International School Of Physics written by Bruce J Berne and published by World Scientific. This book was released on 1998-06-17 with total page 881 pages. Available in PDF, EPUB and Kindle. Book excerpt: The school held at Villa Marigola, Lerici, Italy, in July 1997 was very much an educational experiment aimed not just at teaching a new generation of students the latest developments in computer simulation methods and theory, but also at bringing together researchers from the condensed matter computer simulation community, the biophysical chemistry community and the quantum dynamics community to confront the shared problem: the development of methods to treat the dynamics of quantum condensed phase systems.This volume collects the lectures delivered there. Due to the focus of the school, the contributions divide along natural lines into two broad groups: (1) the most sophisticated forms of the art of computer simulation, including biased phase space sampling schemes, methods which address the multiplicity of time scales in condensed phase problems, and static equilibrium methods for treating quantum systems; (2) the contributions on quantum dynamics, including methods for mixing quantum and classical dynamics in condensed phase simulations and methods capable of treating all degrees of freedom quantum-mechanically.

Molecular Force Sensors

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Publisher : American Chemical Society
ISBN 13 : 084129917X
Total Pages : 201 pages
Book Rating : 4.8/5 (412 download)

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Book Synopsis Molecular Force Sensors by : Rachel Bender

Download or read book Molecular Force Sensors written by Rachel Bender and published by American Chemical Society. This book was released on 2022-03-09 with total page 201 pages. Available in PDF, EPUB and Kindle. Book excerpt: Molecular force sensors are a powerful tool for studying the mechanics of cells. These sensors not only provide information on the general mechanical behavior of cells but also can help elucidate the mechanical markers of disease formation and progression. For example, can we use cell mechanics as a biomarker to diagnose cancer? What are the mechanics associated with immune system function? Can cell mechanics be used to better understand the effect of drug treatments? The number of available questions in the field of mechanobiology is endless. After reading this e-book, you will be equipped with the information needed to begin designing your own molecular force sensors, and to begin answering the multitude of questions surrounding cell mechanobiology.

Clay-Polymer Nanocomposites

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Publisher : Elsevier
ISBN 13 : 0323461611
Total Pages : 548 pages
Book Rating : 4.3/5 (234 download)

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Book Synopsis Clay-Polymer Nanocomposites by : Khouloud Jlassi

Download or read book Clay-Polymer Nanocomposites written by Khouloud Jlassi and published by Elsevier. This book was released on 2017-07-26 with total page 548 pages. Available in PDF, EPUB and Kindle. Book excerpt: Clay–Polymer Nanocomposites is a complete summary of the existing knowledge on this topic, from the basic concepts of synthesis and design to their applications in timely topics such as high-performance composites, environment, and energy issues. This book covers many aspects of synthesis such as in- situ polymerization within the interlamellar spacing of the clays or by reaction of pristine or pre-modified clays with reactive polymers and prepolymers. Indeed, nanocomposites can be prepared at industrial scale by melt mixing. Regardless the synthesis method, much is said in this book about the importance of theclay pre-modification step, which is demonstrated to be effective, on many occasions, in obtaining exfoliated nanocomposites. Clay–Polymer Nanocomposites reports the background to numerous characterization methods including solid state NMR, neutron scattering, diffraction and vibrational techniques as well as surface analytical methods, namely XPS, inverse gas chromatography and nitrogen adsorption to probe surface composition, wetting and textural/structural properties. Although not described in dedicated chapters, numerous X-ray diffraction patterns of clay–polymer nanocomposites and reference materials are displayed to account for the effects of intercalation and exfoliations of layered aluminosilicates. Finally, multiscale molecular simulation protocols are presenting for predicting morphologies and properties of nanostructured polymer systems with industrial relevance. As far as applications are concerned, Clay–Polymer Nanocomposites examines structural composites such as clay–epoxy and clay–biopolymers, the use of clay–polymer nanocomposites as reactive nanocomposite fillers, catalytic clay-(conductive) polymers and similar nanocomposites for the uptake of hazardous compounds or for controlled drug release, antibacterial applications, energy storage, and more. - The most comprehensive coverage of the state of the art in clay–polymer nanocomposites, from synthesis and design to opportunities and applications - Covers the various methods of characterization of clay–polymer nanocomposites - including spectroscopy, thermal analyses, and X-ray diffraction - Includes a discussion of a range of application areas, including biomedicine, energy storage, biofouling resistance, and more

Polymer Glasses

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Publisher : CRC Press
ISBN 13 : 1315305135
Total Pages : 587 pages
Book Rating : 4.3/5 (153 download)

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Book Synopsis Polymer Glasses by : Connie B. Roth

Download or read book Polymer Glasses written by Connie B. Roth and published by CRC Press. This book was released on 2016-12-12 with total page 587 pages. Available in PDF, EPUB and Kindle. Book excerpt: "the present book will be of great value for both newcomers to the field and mature active researchers by serving as a coherent and timely introduction to some of the modern approaches, ideas, results, emerging understanding, and many open questions in this fascinating field of polymer glasses, supercooled liquids, and thin films" –Kenneth S. Schweizer, Morris Professor of Materials Science & Engineering, University of Illinois at Urbana-Champaign (from the Foreword) This book provides a timely and comprehensive overview of molecular level insights into polymer glasses in confined geometries and under deformation. Polymer glasses have become ubiquitous to our daily life, from the polycarbonate eyeglass lenses on the end of our nose to large acrylic glass panes holding water in aquarium tanks, with advantages over glass in that they are lightweight and easy to manufacture, while remaining transparent and rigid. The contents include an introduction to the field, as well as state of the art investigations. Chapters delve into studies of commonalities across different types of glass formers (polymers, small molecules, colloids, and granular materials), which have enabled microscopic and molecular level frameworks to be developed. The authors show how glass formers are modeled across different systems, thereby leading to treatments for polymer glasses with first-principle based approaches and molecular level detail. Readers across disciplines will benefit from this topical overview summarizing the key areas of polymer glasses, alongside an introduction to the main principles and approaches.

Metal-Organic Framework Materials

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Publisher : John Wiley & Sons
ISBN 13 : 1118931580
Total Pages : 1210 pages
Book Rating : 4.1/5 (189 download)

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Book Synopsis Metal-Organic Framework Materials by : Leonard R. MacGillivray

Download or read book Metal-Organic Framework Materials written by Leonard R. MacGillivray and published by John Wiley & Sons. This book was released on 2014-09-19 with total page 1210 pages. Available in PDF, EPUB and Kindle. Book excerpt: Metal-Organic Frameworks (MOFs) are crystalline compounds consisting of rigid organic molecules held together and organized by metal ions or clusters. Special interests in these materials arise from the fact that many are highly porous and can be used for storage of small molecules, for example H2 or CO2. Consequently, the materials are ideal candidates for a wide range of applications including gas storage, separation technologies and catalysis. Potential applications include the storage of hydrogen for fuel-cell cars, and the removal and storage of carbon dioxide in sustainable technical processes. MOFs offer the inorganic chemist and materials scientist a wide range of new synthetic possibilities and open the doors to new and exciting basic research. Metal-Organic Frameworks Materials provides a solid basis for the understanding of MOFs and insights into new inorganic materials structures and properties. The volume also reflects progress that has been made in recent years, presenting a wide range of new applications including state-of-the art developments in the promising technology for alternative fuels. The comprehensive volume investigates structures, symmetry, supramolecular chemistry, surface engineering, recognition, properties, and reactions. The content from this book will be added online to the Encyclopedia of Inorganic and Bioinorganic Chemistry: http://www.wileyonlinelibrary.com/ref/eibc

Chitin and Chitosan

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Publisher : John Wiley & Sons
ISBN 13 : 1119450438
Total Pages : 534 pages
Book Rating : 4.1/5 (194 download)

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Book Synopsis Chitin and Chitosan by : Lambertus A. M. van den Broek

Download or read book Chitin and Chitosan written by Lambertus A. M. van den Broek and published by John Wiley & Sons. This book was released on 2020-01-21 with total page 534 pages. Available in PDF, EPUB and Kindle. Book excerpt: Offers a comprehensive guide to the isolation, properties and applications of chitin and chitosan Chitin and Chitosan: Properties and Applications presents a comprehensive review of the isolation, properties and applications of chitin and chitosan. These promising biomaterials have the potential to be broadly applied and there is a growing market for these biopolymers in areas such as medical and pharmaceutical, packaging, agricultural, textile, cosmetics, nanoparticles and more. The authors – noted experts in the field – explore the isolation, characterization and the physical and chemical properties of chitin and chitosan. They also examine their properties such as hydrogels, immunomodulation and biotechnology, antimicrobial activity and chemical enzymatic modifications. The book offers an analysis of the myriad medical and pharmaceutical applications as well as a review of applications in other areas. In addition, the authors discuss regulations, markets and perspectives for the use of chitin and chitosan. This important book: Offers a thorough review of the isolation, properties and applications of chitin and chitosan. Contains information on the wide-ranging applications and growing market demand for chitin and chitosan Includes a discussion of current regulations and the outlook for the future Written for Researchers in academia and industry who are working in the fields of chitin and chitosan, Chitin and Chitosan: Properties and Applications offers a review of these promising biomaterials that have great potential due to their material properties and biological functionalities.

Graphdiyne

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Publisher : John Wiley & Sons
ISBN 13 : 3527347879
Total Pages : 404 pages
Book Rating : 4.5/5 (273 download)

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Book Synopsis Graphdiyne by : Yuliang Li

Download or read book Graphdiyne written by Yuliang Li and published by John Wiley & Sons. This book was released on 2022-01-10 with total page 404 pages. Available in PDF, EPUB and Kindle. Book excerpt: Graphdiyne Discover the most cutting-edge developments in the study of graphdiyne from a pioneer of the field In Graphdiyne: Fundamentals and Applications in Renewable Energy and Electronics, accomplished chemist Dr. Yuliang Li delivers a practical and insightful compilation of theoretical and experimental developments in the study of graphdiyne. Of interest to both academics and industrial researchers in the fields of nanoscience, organic chemistry, carbon science, and renewable energies, the book systematically summarizes recent research into the exciting new material. Discover information about the properties of graphdiyne through theoretical simulations and experimental characterizations, as well as the development of graphdiyne with appropriate preparation technology. Learn to create new graphdiyne-based materials and better understand its intrinsic properties. Find out about synthetic methodologies, the controlled growth of aggregated state structures, and structural characterization. In addition to demonstrating the interdisciplinary potential and relevance of graphdiyne, the book also offers readers: A thorough introduction to basic structure and band gap engineering, including molecular and electronic structure, mechanical properties, and the layers structure of bulk graphdiyne Explorations of Graphdiyne synthesis and characterization, including films, nanotube arrays and nanowires, nanowalls, and nanosheets, as well as characterization methods Discussions of the functionalization of graphdiyne, including heteroatom doping, metal decoration, and absorption of guest molecules Rigorous treatments of Graphdiyne-based materials in catalytic applications, including photo- and electrocatalysts Perfect for organic chemists, electronics engineers, materials scientists, and physicists, Graphdiyne: Fundamentals and Applications in Renewable Energy and Electronics will also find its place on the bookshelves of surface and solid-state chemists, electrochemists, and catalytic chemists seeking a one-stop reference on this rising-star carbon material.

Nanomaterials: A Danger or a Promise?

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Publisher : Springer Science & Business Media
ISBN 13 : 1447142136
Total Pages : 398 pages
Book Rating : 4.4/5 (471 download)

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Book Synopsis Nanomaterials: A Danger or a Promise? by : Roberta Brayner

Download or read book Nanomaterials: A Danger or a Promise? written by Roberta Brayner and published by Springer Science & Business Media. This book was released on 2012-08-10 with total page 398 pages. Available in PDF, EPUB and Kindle. Book excerpt: With the increased presence of nanomaterials in commercial products such as cosmetics and sunscreens, fillers in dental fillings, water filtration process, catalysis, photovoltaic cells, bio-detection, a growing public debate is emerging on toxicological and environmental effects of direct and indirect exposure to these materials. Nanomaterials: A Danger or a Promise? forms a balanced overview of the health and environmental issues of nanoscale materials. By considering both the benefits and risks associated with nanomaterials, Nanomaterials: A Danger or a Promise? compiles a complete and detailed image of the many aspects of the interface between nanomaterials and their real-life application. The full cycle of nanomaterials life will be presented and critically assessed to consider and answer questions such as: How are nanomaterials made? What they are used for? What is their environmental fate? Can we make them better? Including coverage of relevant aspects about the toxicity of manufactured nanomaterials, nanomaterials life cycle, exposure issues, Nanomaterials: A Danger or a Promise? provides a comprehensive overview of the actual knowledge in these fields but also presents perspectives for the future development of a safer nanoscience. This comprehensive resource is a key reference for students, researcher, manufacturers and industry professionals alike.

Nanoalloys

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Publisher : Newnes
ISBN 13 : 0123946166
Total Pages : 433 pages
Book Rating : 4.1/5 (239 download)

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Book Synopsis Nanoalloys by : Florent Calvo

Download or read book Nanoalloys written by Florent Calvo and published by Newnes. This book was released on 2013-03-12 with total page 433 pages. Available in PDF, EPUB and Kindle. Book excerpt: Nanoalloys: From Fundamentals to Emergent Applications presents and discusses the major topics related to nanoalloys at a time when the literature on the subject remains scarce. Particular attention is paid to experimental and theoretical aspects under the form of broad reviews covering the most recent developments. The book is organized into 11 chapters covering the most fundamental aspects of nanoalloys related to their synthesis and characterization, as well as their theoretical study. Aspects related to their thermodynamics and kinetics are covered as well. The coverage then moves to more specific topics, including optics, magnetism and catalysis, and finally to biomedical applications and the technologically relevant issue of self-assembly.With no current single reference source on the subject, the work is invaluable for researchers as the nanoscience field moves swiftly to full monetization. - Encapsulates physical science of structure, properties, size, composition and ordering at nanoscale, aiding synthesis of experimentation and modelling - Multi-expert and interdisciplinary perspectives on growth, synthesis and characterization of bimetallic clusters and particulates supports expansion of your current research activity into applications - Synthesizes concepts and draws links between fundamental metallurgy and cutting edge nanoscience, aiding interdisciplinary research activity

Spectroscopic Methods in the Study of Kaolin Minerals and Their Modifications

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Author :
Publisher : Springer
ISBN 13 : 3030023737
Total Pages : 434 pages
Book Rating : 4.0/5 (3 download)

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Book Synopsis Spectroscopic Methods in the Study of Kaolin Minerals and Their Modifications by : Jacob (Theo) Kloprogge

Download or read book Spectroscopic Methods in the Study of Kaolin Minerals and Their Modifications written by Jacob (Theo) Kloprogge and published by Springer. This book was released on 2018-12-10 with total page 434 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book systematically provides an overview of the use of a wide range of spectroscopic methods (Mid- and Near-Infrared, Infrared Emission, Raman, Solid-State Magic Angle Spinning Nuclear Magnetic Resonance, X-ray Photoelectron, Extended X-ray Absorption Fine Structure, X-ray Absorption Near Edge, Electron Spin and Mössbauer spectroscopy) to investigate kaolin minerals (kaolinite, dickite, nacrite and halloysite) and their modifications (intercalation compounds, nanocomposites and other modifications).

Nanotechnologies in Preventive and Regenerative Medicine

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Publisher : Elsevier
ISBN 13 : 0323480640
Total Pages : 618 pages
Book Rating : 4.3/5 (234 download)

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Book Synopsis Nanotechnologies in Preventive and Regenerative Medicine by : Vuk Uskokovic

Download or read book Nanotechnologies in Preventive and Regenerative Medicine written by Vuk Uskokovic and published by Elsevier. This book was released on 2017-10-30 with total page 618 pages. Available in PDF, EPUB and Kindle. Book excerpt: Nanotechnologies in Preventative and Regenerative Medicine demonstrates how control at the nanoscale can help achieve earlier diagnoses and create more effective treatments. Chapters take a logical approach, arranging materials by their area of application. Biomaterials are, by convention, divided according to the area of their application, with each chapter outlining current challenges before discussing how nanotechnology and nanomaterials can help solve these challenges This applications-orientated book is a valuable resource for researchers in biomedical science who want to gain a greater understanding on how nanotechnology can help create more effective vaccines and treatments, and to nanomaterials researchers seeking to gain a greater understanding of how these materials are applied in medicine. - Demonstrates how nanotechnology can help achieve more successful diagnoses at an earlier stage - Explains how nanomaterials can be manipulated to create more effective drug treatments - Offers suggestions on how the use of nanotechnology might have future applications to create even more effective treatments

The Origin and Early Evolution of Life: Prebiotic Chemistry of Biomolecules

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Publisher : MDPI
ISBN 13 : 3039216066
Total Pages : 288 pages
Book Rating : 4.0/5 (392 download)

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Book Synopsis The Origin and Early Evolution of Life: Prebiotic Chemistry of Biomolecules by : Michele Fiore

Download or read book The Origin and Early Evolution of Life: Prebiotic Chemistry of Biomolecules written by Michele Fiore and published by MDPI. This book was released on 2019-10-29 with total page 288 pages. Available in PDF, EPUB and Kindle. Book excerpt: Studying the origin of life is one of man’s greatest achievements over the last sixty years. The fields of interest encompassed by this quest are multiple and interdisciplinary: chemistry, physics, biology, biochemistry, mathematics, geology but also statistics, atmospheric science, meteorology, oceanography, and astrophysics. Recent scientific discoveries, such as water on Mars and the existence of super-Earths with atmospheres similar to primordial Earth, have pushed researchers to simulate prebiotic conditions in explaining the abiotic formation of molecules essential to life. This collection of articles offers an overview of recent discoveries in the field of prebiotic chemistry of biomolecules, their formation and selection, and the evolution of complex chemical systems.

Macromolecular Crystallography

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Publisher : Gulf Professional Publishing
ISBN 13 : 9780121827779
Total Pages : 754 pages
Book Rating : 4.8/5 (277 download)

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Book Synopsis Macromolecular Crystallography by : Charles W. Carter

Download or read book Macromolecular Crystallography written by Charles W. Carter and published by Gulf Professional Publishing. This book was released on 1997 with total page 754 pages. Available in PDF, EPUB and Kindle. Book excerpt: Annotation Accurate molecular structures is vital for rational drug design and for structure based functional studies directed toward the development of effective therapeutic agents and drugs. Crystallography can reliably predict structure, both in terms of folding and atomic details of bonding. * Phases * Map interpretation and refinement * Analysis and software.

Surface Charging and Points of Zero Charge

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Publisher : CRC Press
ISBN 13 : 142005189X
Total Pages : 1094 pages
Book Rating : 4.4/5 (2 download)

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Book Synopsis Surface Charging and Points of Zero Charge by : Marek Kosmulski

Download or read book Surface Charging and Points of Zero Charge written by Marek Kosmulski and published by CRC Press. This book was released on 2009-05-14 with total page 1094 pages. Available in PDF, EPUB and Kindle. Book excerpt: The Most Detailed Resource Available on Points of Zero ChargeWith their work growing in complexity, chemists involved with surface phenomena-related projects have outgrown the common resources available to them on points of zero charge (PZC) of oxides. Reporting on a limited number of materials in a limited number of scenarios, these resources ofte

Molecular Architectonics and Nanoarchitectonics

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Publisher :
ISBN 13 : 9789811641909
Total Pages : 0 pages
Book Rating : 4.6/5 (419 download)

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Book Synopsis Molecular Architectonics and Nanoarchitectonics by : Thimmaiah Govindaraju

Download or read book Molecular Architectonics and Nanoarchitectonics written by Thimmaiah Govindaraju and published by . This book was released on 2022 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is the ultimate assembly of recent research activities on molecular architectonics and nanoarchitectonics by authors who are worldwide experts. The book proposes new ways of creating functional materials at the nano level using the concepts of molecular architectonics and nanoarchitectonics, which are expected to be the next-generation approaches beyond conventional nanotechnology. All the contents are categorized by types of materials, organic materials, biomaterials, and nanomaterials. For that reason, non-specialists including graduate and undergraduate students can start reading the book from any points they would like. Cutting-edge trends in nanotechnology and material sciences are easily visible in the contents of the book, which is highly useful for both students and experimental materials scientists. .

Iridium Catalysis

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Publisher : Springer Science & Business Media
ISBN 13 : 364215333X
Total Pages : 244 pages
Book Rating : 4.6/5 (421 download)

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Book Synopsis Iridium Catalysis by : Pher G. Andersson

Download or read book Iridium Catalysis written by Pher G. Andersson and published by Springer Science & Business Media. This book was released on 2011-01-05 with total page 244 pages. Available in PDF, EPUB and Kindle. Book excerpt: From the contents: Robert H Crabtree: Introduction and History. - Montserrat Diéguez, Oscar Pàmies and Carmen Claver: Iridium-catalysed hydrogenation using phosphorous ligands. - David H. Woodmansee and Andreas Pfaltz: Iridium Catalyzed Asymmetric Hydrogenation of Olefins with Chiral N,P and C,N Ligands. - Ourida Saidi and Jonathan M J Williams: Iridium-catalyzed Hydrogen Transfer Reactions. - John F. Bower and Michael J. Krische: Formation of C-C Bonds via Iridium Catalyzed Hydrogenation and Transfer Hydrogenation. - Jongwook Choi, Alan S. Goldman: Ir-Catalyzed Functionalization of CH Bonds. - Mark P. Pouy and John F. Hartwig: Iridium-Catalyzed Allylic Substitution. - Daniel Carmona and Luis A. Oro: Iridium-catalyzed 1.3-dipolar cycloadditions.

Organic Stereochemistry

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Publisher : Wiley-VCH
ISBN 13 : 9783906390697
Total Pages : 0 pages
Book Rating : 4.3/5 (96 download)

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Book Synopsis Organic Stereochemistry by : Bernard Testa

Download or read book Organic Stereochemistry written by Bernard Testa and published by Wiley-VCH. This book was released on 2014-06-09 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: "This book should become an indispensable asset on the bookshelves of pharmaceutical laboratories in academia and in industry, as well as of laboratories devoted to plant protection. I am convinced that studying this book will be an eye-opener for many scientists in the field of life sciences. Furthermore, for teachers in this area it will not only be a useful compilation of the various languages and definitions of organic stereochemistry, but also a welcome source of examples for demonstrating to their students the intricate and intriguing role stereochemistry plays in the chemistry of life." - Prof. Dr. Dieter Seebach, Laboratory of Organic Chemistry, ETH Zurich, Switzerland This textbook presents the molecular scale of matter in the broad diversity and richness of its three dimensions, giving due attention when relevant to the temporal dimension in which molecules exist, act, and react. The focus is on two significant fields of three-dimensional chemistry: a presentation of the guiding principles in organic stereochemistry, followed by a focus on the biochemical and medicinal relevance of this discipline. The treatment of Guiding Principles gives priority to didactic clarity and nomenclature issues, as detailed and illustrated in Parts 1 to 4: 'Symmetry Elements and Operations, Classification of Stereoisomers' 'Stereoisomerism Resulting from One or Several Stereogenic Centers' 'Other Stereogenic Elements: Axes of Chirality, Planes of Chirality, Helicity, and (E,Z)-Diastereoisomerism' 'Isomerisms about Single Bonds and in Cyclic Systems' This is followed by Parts 5 to 8 which focus on the biomedicinal relevance of stereochemistry, with special reference to the biochemistry and pharmacology of medicinal compounds. Here, examples and applications are discussed and illustrated based on their relevance to a given specific stereochemical aspect: 'Chirality in Molecular and Clinical Pharmacology' 'The Conformational Factor in Molecular Pharmacology' 'The Concept of Substrate Stereoselectivity in Biochemistry and Xenobiotic Metabolism' 'Prostereoisomerism and the Concept of Product Stereoselectivity in Xenobiotic Metabolism' Finally, the book contains a gift for broad-minded readers with an interest in the historical roots of stereochemistry: 'Molecular Chirality in Chemistry and Biology: Historical Milestones' Key features: * Consists entirely of beautifully produced colored figures * Includes marginal notes, giving clear-cut short definitions of terms used in the corresponding caption * Provides an alphabetic glossary of terms * Offers an extensive index