Models, Mysteries, and Magic of Molecules

Models, Mysteries, and Magic of Molecules

Author: Jan C. A. Boeyens

Publisher: Springer Science & Business Media

Published: 2008-03-11

Total Pages: 515

ISBN-13: 140205940X

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The Indaba 5 meeting, held in South Africa during August 2006, examined the progress being made to achieve first-principle understanding of molecular science and confirmed the need to better understand the mysteries and magic of molecules. This book explores the common ground to guide chemists, biologists, crystallographers, spectroscopists and theorists towards painting a holistic picture of scientific endeavor.


Book Synopsis Models, Mysteries, and Magic of Molecules by : Jan C. A. Boeyens

Download or read book Models, Mysteries, and Magic of Molecules written by Jan C. A. Boeyens and published by Springer Science & Business Media. This book was released on 2008-03-11 with total page 515 pages. Available in PDF, EPUB and Kindle. Book excerpt: The Indaba 5 meeting, held in South Africa during August 2006, examined the progress being made to achieve first-principle understanding of molecular science and confirmed the need to better understand the mysteries and magic of molecules. This book explores the common ground to guide chemists, biologists, crystallographers, spectroscopists and theorists towards painting a holistic picture of scientific endeavor.


Ideas in Chemistry and Molecular Sciences

Ideas in Chemistry and Molecular Sciences

Author: Bruno Pignataro

Publisher: John Wiley & Sons

Published: 2010-04-16

Total Pages: 432

ISBN-13: 9783527630547

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Written by some of the most talented young chemists in Europe, this text covers most of the groundbreaking issues in materials science. It provides an account of the latest research results in European materials chemistry based on a selection of leading young scientists participating in the 2008 European Young Chemists Award competition. The contributions range from nanotechnology to catalysis. In addition, the authors provide a current overview of their field of research and a preview of future directions. For materials scientists, as well as organic and analytical chemists.


Book Synopsis Ideas in Chemistry and Molecular Sciences by : Bruno Pignataro

Download or read book Ideas in Chemistry and Molecular Sciences written by Bruno Pignataro and published by John Wiley & Sons. This book was released on 2010-04-16 with total page 432 pages. Available in PDF, EPUB and Kindle. Book excerpt: Written by some of the most talented young chemists in Europe, this text covers most of the groundbreaking issues in materials science. It provides an account of the latest research results in European materials chemistry based on a selection of leading young scientists participating in the 2008 European Young Chemists Award competition. The contributions range from nanotechnology to catalysis. In addition, the authors provide a current overview of their field of research and a preview of future directions. For materials scientists, as well as organic and analytical chemists.


Biomolecular Simulations in Structure-Based Drug Discovery

Biomolecular Simulations in Structure-Based Drug Discovery

Author: Francesco L. Gervasio

Publisher: John Wiley & Sons

Published: 2019-04-29

Total Pages: 368

ISBN-13: 3527342656

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A guide to applying the power of modern simulation tools to better drug design Biomolecular Simulations in Structure-based Drug Discovery offers an up-to-date and comprehensive review of modern simulation tools and their applications in real-life drug discovery, for better and quicker results in structure-based drug design. The authors describe common tools used in the biomolecular simulation of drugs and their targets and offer an analysis of the accuracy of the predictions. They also show how to integrate modeling with other experimental data. Filled with numerous case studies from different therapeutic fields, the book helps professionals to quickly adopt these new methods for their current projects. Experts from the pharmaceutical industry and academic institutions present real-life examples for important target classes such as GPCRs, ion channels and amyloids as well as for common challenges in structure-based drug discovery. Biomolecular Simulations in Structure-based Drug Discovery is an important resource that: -Contains a review of the current generation of biomolecular simulation tools that have the robustness and speed that allows them to be used as routine tools by non-specialists -Includes information on the novel methods and strategies for the modeling of drug-target interactions within the framework of real-life drug discovery and development -Offers numerous illustrative case studies from a wide-range of therapeutic fields -Presents an application-oriented reference that is ideal for those working in the various fields Written for medicinal chemists, professionals in the pharmaceutical industry, and pharmaceutical chemists, Biomolecular Simulations in Structure-based Drug Discovery is a comprehensive resource to modern simulation tools that complement and have the potential to complement or replace laboratory assays for better results in drug design.


Book Synopsis Biomolecular Simulations in Structure-Based Drug Discovery by : Francesco L. Gervasio

Download or read book Biomolecular Simulations in Structure-Based Drug Discovery written by Francesco L. Gervasio and published by John Wiley & Sons. This book was released on 2019-04-29 with total page 368 pages. Available in PDF, EPUB and Kindle. Book excerpt: A guide to applying the power of modern simulation tools to better drug design Biomolecular Simulations in Structure-based Drug Discovery offers an up-to-date and comprehensive review of modern simulation tools and their applications in real-life drug discovery, for better and quicker results in structure-based drug design. The authors describe common tools used in the biomolecular simulation of drugs and their targets and offer an analysis of the accuracy of the predictions. They also show how to integrate modeling with other experimental data. Filled with numerous case studies from different therapeutic fields, the book helps professionals to quickly adopt these new methods for their current projects. Experts from the pharmaceutical industry and academic institutions present real-life examples for important target classes such as GPCRs, ion channels and amyloids as well as for common challenges in structure-based drug discovery. Biomolecular Simulations in Structure-based Drug Discovery is an important resource that: -Contains a review of the current generation of biomolecular simulation tools that have the robustness and speed that allows them to be used as routine tools by non-specialists -Includes information on the novel methods and strategies for the modeling of drug-target interactions within the framework of real-life drug discovery and development -Offers numerous illustrative case studies from a wide-range of therapeutic fields -Presents an application-oriented reference that is ideal for those working in the various fields Written for medicinal chemists, professionals in the pharmaceutical industry, and pharmaceutical chemists, Biomolecular Simulations in Structure-based Drug Discovery is a comprehensive resource to modern simulation tools that complement and have the potential to complement or replace laboratory assays for better results in drug design.


Structure and Function

Structure and Function

Author: Peter Comba

Publisher: Springer Science & Business Media

Published: 2009-12-02

Total Pages: 269

ISBN-13: 9048128889

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The art of chemistry is to thoroughly understand the properties of molecular compounds and materials and to be able to prepare novel compounds with p- dicted and desirable properties. The basis for progress is to fully appreciate and fundamentally understand the intimate relation between structure and function. The thermodynamic properties (stability, selectivity, redox potential), reactivities (bond breaking and formation, catalysis, electron transfer) and electronic properties (spectroscopy, magnetism) depend on the structure of a compound. Nevertheless, the discovery of novel molecular compounds and materials with exciting prop- ties is often and to a large extent based on serendipity. For compounds with novel and exciting properties, a thorough analysis of experimental data – state-of-the-art spectroscopy, magnetism, thermodynamic properties and/or detailed mechanistic information – combined with sophisticated electronic structure calculations is p- formed to interpret the results and fully understand the structure, properties and their interrelation. From these analyses, new models and theories may emerge, and this has led to the development of ef cient models for the design and interpre- tion of new materials and important new experiments. The chapters in this book therefore describe various fundamental aspects of structures, dynamics and physics of molecules and materials. The approaches, data and models discussed include new theoretical developments, computational studies and experimental work from molecular chemistry to biology and materials science.


Book Synopsis Structure and Function by : Peter Comba

Download or read book Structure and Function written by Peter Comba and published by Springer Science & Business Media. This book was released on 2009-12-02 with total page 269 pages. Available in PDF, EPUB and Kindle. Book excerpt: The art of chemistry is to thoroughly understand the properties of molecular compounds and materials and to be able to prepare novel compounds with p- dicted and desirable properties. The basis for progress is to fully appreciate and fundamentally understand the intimate relation between structure and function. The thermodynamic properties (stability, selectivity, redox potential), reactivities (bond breaking and formation, catalysis, electron transfer) and electronic properties (spectroscopy, magnetism) depend on the structure of a compound. Nevertheless, the discovery of novel molecular compounds and materials with exciting prop- ties is often and to a large extent based on serendipity. For compounds with novel and exciting properties, a thorough analysis of experimental data – state-of-the-art spectroscopy, magnetism, thermodynamic properties and/or detailed mechanistic information – combined with sophisticated electronic structure calculations is p- formed to interpret the results and fully understand the structure, properties and their interrelation. From these analyses, new models and theories may emerge, and this has led to the development of ef cient models for the design and interpre- tion of new materials and important new experiments. The chapters in this book therefore describe various fundamental aspects of structures, dynamics and physics of molecules and materials. The approaches, data and models discussed include new theoretical developments, computational studies and experimental work from molecular chemistry to biology and materials science.


Practical Approaches to Biological Inorganic Chemistry

Practical Approaches to Biological Inorganic Chemistry

Author: Robert R. Crichton

Publisher: Elsevier

Published: 2019-09-10

Total Pages: 504

ISBN-13: 0444642269

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Practical Approaches to Biological Inorganic Chemistry, Second Edition, reviews the use of spectroscopic and related analytical techniques to investigate the complex structures and mechanisms of biological inorganic systems that contain metals. Each chapter presents an overview of the technique, including relevant theory, a clear explanation of what it is, how it works, and how the technique is actually used to evaluate biological structures. New chapters cover Raman Spectroscopy and Molecular Magnetochemistry, but all chapters have been updated to reflect the latest developments in discussed techniques. Practical examples, problems and many color figures are also included to illustrate key concepts. The book is designed for researchers and students who want to learn both the basics and more advanced aspects of key methods in biological inorganic chemistry. Presents new chapters on Raman Spectroscopy and Molecular Magnetochemistry, as well as updated figures and content throughout Includes color images throughout to enable easier visualization of molecular mechanisms and structures Provides worked examples and problems to help illustrate and test the reader’s understanding of each technique Written by leading experts who use and teach the most important techniques used today to analyze complex biological structures


Book Synopsis Practical Approaches to Biological Inorganic Chemistry by : Robert R. Crichton

Download or read book Practical Approaches to Biological Inorganic Chemistry written by Robert R. Crichton and published by Elsevier. This book was released on 2019-09-10 with total page 504 pages. Available in PDF, EPUB and Kindle. Book excerpt: Practical Approaches to Biological Inorganic Chemistry, Second Edition, reviews the use of spectroscopic and related analytical techniques to investigate the complex structures and mechanisms of biological inorganic systems that contain metals. Each chapter presents an overview of the technique, including relevant theory, a clear explanation of what it is, how it works, and how the technique is actually used to evaluate biological structures. New chapters cover Raman Spectroscopy and Molecular Magnetochemistry, but all chapters have been updated to reflect the latest developments in discussed techniques. Practical examples, problems and many color figures are also included to illustrate key concepts. The book is designed for researchers and students who want to learn both the basics and more advanced aspects of key methods in biological inorganic chemistry. Presents new chapters on Raman Spectroscopy and Molecular Magnetochemistry, as well as updated figures and content throughout Includes color images throughout to enable easier visualization of molecular mechanisms and structures Provides worked examples and problems to help illustrate and test the reader’s understanding of each technique Written by leading experts who use and teach the most important techniques used today to analyze complex biological structures


Engineering of Crystalline Materials Properties

Engineering of Crystalline Materials Properties

Author: Juan J. Novoa

Publisher: Springer Science & Business Media

Published: 2007-12-14

Total Pages: 520

ISBN-13: 1402068239

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This volume collects the state of the art in molecular materials. It collects the lecture notes of a series of lectures given by some of the best specialists in the field at the 2007 Erice International School of Crystallography, and also a NATO-ASI course. The school first established "where we are" in terms of modeling, design, synthesis and applications of crystalline solids with predefined properties and then defined current and possible futuristic lines of development.


Book Synopsis Engineering of Crystalline Materials Properties by : Juan J. Novoa

Download or read book Engineering of Crystalline Materials Properties written by Juan J. Novoa and published by Springer Science & Business Media. This book was released on 2007-12-14 with total page 520 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume collects the state of the art in molecular materials. It collects the lecture notes of a series of lectures given by some of the best specialists in the field at the 2007 Erice International School of Crystallography, and also a NATO-ASI course. The school first established "where we are" in terms of modeling, design, synthesis and applications of crystalline solids with predefined properties and then defined current and possible futuristic lines of development.


High-Pressure Crystallography

High-Pressure Crystallography

Author: Elena Boldyreva

Publisher: Springer Science & Business Media

Published: 2010-09-03

Total Pages: 602

ISBN-13: 9048192609

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This unique book is devoted to the theme of crystallographic studies at high pressure. It places emphasis on the phenomena characteristic to the compressed state of matter, as well as experimental and theoretical techniques, used to study these phenomena.


Book Synopsis High-Pressure Crystallography by : Elena Boldyreva

Download or read book High-Pressure Crystallography written by Elena Boldyreva and published by Springer Science & Business Media. This book was released on 2010-09-03 with total page 602 pages. Available in PDF, EPUB and Kindle. Book excerpt: This unique book is devoted to the theme of crystallographic studies at high pressure. It places emphasis on the phenomena characteristic to the compressed state of matter, as well as experimental and theoretical techniques, used to study these phenomena.


Crystallography of Modular Materials

Crystallography of Modular Materials

Author: Giovanni Ferraris

Publisher: Oxford University Press on Demand

Published: 2004

Total Pages: 383

ISBN-13: 0198526644

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This comprehensive text is addressed at scientists who are interested in considering crystalline materials from a non-conventional but inspiring viewpoint. It contains the first systematic theoretical and illustrative presentation of crystalline materials built from modules.


Book Synopsis Crystallography of Modular Materials by : Giovanni Ferraris

Download or read book Crystallography of Modular Materials written by Giovanni Ferraris and published by Oxford University Press on Demand. This book was released on 2004 with total page 383 pages. Available in PDF, EPUB and Kindle. Book excerpt: This comprehensive text is addressed at scientists who are interested in considering crystalline materials from a non-conventional but inspiring viewpoint. It contains the first systematic theoretical and illustrative presentation of crystalline materials built from modules.


The Tao of Life

The Tao of Life

Author: Roland Frey

Publisher: tredition

Published: 2016-11-03

Total Pages: 164

ISBN-13: 373456459X

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The book describes a hypothesis on the origin of life on earth. It assumes that the microcosmic molecular basis of life arose by adaptation to the overlaying macrocosmic astronomical rhythms impacting on the earth. Viewed from the earth these rhythms appear as the 'course' of the sun, the moon and the starry sky. They generate the time cycles of the 24 hour day, of the month and the year and, together, are united in a 'joint rhythm circle' by a fourth rhythm, the 19 years lasting lunisolar cycle (Meton cycle). The basic structure of the Chinese Book of Changes (I Ging) was also derived from the macrocosmic astronomical rhythms impacting on the earth. These rhythms and the resulting 'cyclical time' of the earth were observed by early Chinese and used for creating the Book of Changes as a symbolical microcosmic representation of the macrocosmic rhythms. Therefore, the molecular basis of life and the basic structure of the I Ging resemble each other. According to the presented approach, the basis of life is a microcosmic 'copy' of the macrocosmic rhythms. This provides a simple explanation for the unity of macro- and microcosm in the sense that the microcosm includes the macrocosmic pattern of order in itself.


Book Synopsis The Tao of Life by : Roland Frey

Download or read book The Tao of Life written by Roland Frey and published by tredition. This book was released on 2016-11-03 with total page 164 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book describes a hypothesis on the origin of life on earth. It assumes that the microcosmic molecular basis of life arose by adaptation to the overlaying macrocosmic astronomical rhythms impacting on the earth. Viewed from the earth these rhythms appear as the 'course' of the sun, the moon and the starry sky. They generate the time cycles of the 24 hour day, of the month and the year and, together, are united in a 'joint rhythm circle' by a fourth rhythm, the 19 years lasting lunisolar cycle (Meton cycle). The basic structure of the Chinese Book of Changes (I Ging) was also derived from the macrocosmic astronomical rhythms impacting on the earth. These rhythms and the resulting 'cyclical time' of the earth were observed by early Chinese and used for creating the Book of Changes as a symbolical microcosmic representation of the macrocosmic rhythms. Therefore, the molecular basis of life and the basic structure of the I Ging resemble each other. According to the presented approach, the basis of life is a microcosmic 'copy' of the macrocosmic rhythms. This provides a simple explanation for the unity of macro- and microcosm in the sense that the microcosm includes the macrocosmic pattern of order in itself.


Advanced X-ray Crystallography

Advanced X-ray Crystallography

Author: Kari Rissanen

Publisher: Springer Science & Business Media

Published: 2012-01-10

Total Pages: 190

ISBN-13: 3642274072

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Computational Studies of Crystal Structure and Bonding, by Angelo Gavezzotti Cryo-Crystallography: Diffraction at Low Temperature and More, by Piero Macchi High-Pressure Crystallography, by Malcolm I. McMahon Chemical X-Ray Photodiffraction: Principles, Examples, and Perspectives, by Panče Naumov Powder Diffraction Crystallography of Molecular Solids, by Kenneth D. M. Harris


Book Synopsis Advanced X-ray Crystallography by : Kari Rissanen

Download or read book Advanced X-ray Crystallography written by Kari Rissanen and published by Springer Science & Business Media. This book was released on 2012-01-10 with total page 190 pages. Available in PDF, EPUB and Kindle. Book excerpt: Computational Studies of Crystal Structure and Bonding, by Angelo Gavezzotti Cryo-Crystallography: Diffraction at Low Temperature and More, by Piero Macchi High-Pressure Crystallography, by Malcolm I. McMahon Chemical X-Ray Photodiffraction: Principles, Examples, and Perspectives, by Panče Naumov Powder Diffraction Crystallography of Molecular Solids, by Kenneth D. M. Harris