Computational Approaches in Supramolecular Chemistry PDF Download
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Author: G. Wipff
Publisher:
ISBN: 9789401110594
Category :
Languages : en
Pages : 554
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Book Description
Author: G. Wipff
Publisher:
ISBN: 9789401110594
Category :
Languages : en
Pages : 554
Get Book Here
Book Description
Author: Andrei G. Kutateladze
Publisher: CRC Press
ISBN: 1420030582
Category : Science
Languages : en
Pages : 530
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Book Description
Addressing critical aspects of computational modeling in photochemistry, Molecular Methods in Photochemistry is designed to familiarize researchers and practitioners with state-of-the-art computational methods to predict the reactivity of excited molecules. It provides practical guidelines and examples for the modeling of excited states and describ
Author: G. Wipff
Publisher: Springer Science & Business Media
ISBN: 9401110581
Category : Science
Languages : en
Pages : 529
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Book Description
Supramolecular chemistry has been defined by J.-M. Lehn as "a highly interdisciplinary field of science covering the chemical, physical, and biological features of chemical species of higher complexity, that are held together and organized by means of intermolecular (noncovalent) binding interactions" (Science, 1993). Recognition, reactivity, and transport represent three basic functional features, in essence dynami~s, which may be translated into structural features. The purpose of the NATO workshop which took place september 1-5, 1993 at the Bischenberg (near Strasbourg) was to present computations which may contribute to the atomic level understanding of the structural and thermodynamical features involved in the processes of molecular recognition and supramolecular organization. of "supra-molecular modeling". Other The main focus was therefore, on the many facets applications of computers in chemistry, such as automation, simulation of processes, procedures for fitting kinetic or thermodynamic data, computer assisted synthetic strategies, use of data bases for structure elucidation or for bibliographic searches, have an obvious impact in supramolecular chemistry as well, but were not presented at the workshop.
Author: George W. Gokel
Publisher: Elsevier
ISBN: 0128031999
Category : Science
Languages : en
Pages : 4627
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Book Description
Comprehensive Supramolecular Chemistry II, Second Edition, Nine Volume Set is a ‘one-stop shop’ that covers supramolecular chemistry, a field that originated from the work of researchers in organic, inorganic and physical chemistry, with some biological influence. The original edition was structured to reflect, in part, the origin of the field. However, in the past two decades, the field has changed a great deal as reflected in this new work that covers the general principles of supramolecular chemistry and molecular recognition, experimental and computational methods in supramolecular chemistry, supramolecular receptors, dynamic supramolecular chemistry, supramolecular engineering, crystallographic (engineered) assemblies, sensors, imaging agents, devices and the latest in nanotechnology. Each section begins with an introduction by an expert in the field, who offers an initial perspective on the development of the field. Each article begins with outlining basic concepts before moving on to more advanced material. Contains content that begins with the basics before moving on to more complex concepts, making it suitable for advanced undergraduates as well as academic researchers Focuses on application of the theory in practice, with particular focus on areas that have gained increasing importance in the 21st century, including nanomedicine, nanotechnology and medicinal chemistry Fully rewritten to make a completely up-to-date reference work that covers all the major advances that have taken place since the First Edition published in 1996
Author: Javier Luque
Publisher: Royal Society of Chemistry
ISBN: 1849733538
Category : Medical
Languages : en
Pages : 443
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Book Description
This title covers a wide range of topics relevant to the development of drugs. It provides a comprehensive description of the major methodological strategies available for rational drug discovery.
Author: Peter J. Cragg
Publisher: John Wiley & Sons
ISBN: 0470866543
Category : Science
Languages : en
Pages : 230
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Book Description
A Practical Guide to Supramolecular Chemistry is an introductory manual of practical experiments for chemists with little or no prior experience of supramolecular chemistry. Syntheses are clearly presented to facilitate the preparation of acyclic and macrocyclic compounds frequently encountered in supramolecular chemistry using straightforward experimental procedures. Many of the compounds can be used to illustrate classic supramolecular phenomena, for which clear directions are given, or may be developed further as part of the reader's own research. The book also describes techniques commonly used in the analysis of supramolecular behaviour, including computational methods, with many detailed examples. An invaluable reference for students and researchers in the field embarking on supramolecular chemistry projects and looking for a 'tried and tested' route into the chemistry of key compounds. An introductory guide to practical syntheses focusing on supramolecular chemistry. Fully referenced introductions explain the historical and contemporary importance of each compound Supplementary website including 3D molecular structures, FAQ's about syntheses and suggestions for further experiments
Author: Brian D. Wagner
Publisher: Walter de Gruyter GmbH & Co KG
ISBN: 3110564394
Category : Science
Languages : en
Pages : 359
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Book Description
This textbook addresses the chemical and physicochemical principles of supramolecular host-guest chemistry in solution. It covers the thermodynamics and dynamics of inclusion and highlights several types of organic hosts. Various applications of host-guest chemistry in analytical and environmental chemistry as well as pharmaceutical and chemical industry demonstrate the versatile usability of molecular cages.
Author: Rocco Ungaro
Publisher: Springer Science & Business Media
ISBN: 9401145547
Category : Science
Languages : en
Pages : 331
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Book Description
A summary of all the most important aspects of supramolecular science, from molecular recognition in chemical and biological systems to supramolecular devices, materials and catalysis. The 17 chapters cover calixarenes, catenanes, cavitands, cholophanes, dendrimers, membranes and self-assembly systems, molecular modelling, molecular level devices, organic materials, peptides and protein surfaces, recognition of carbohydrates, rotaxanes, supramolecular catalysis. A forward-looking chapter written by J.-M. Lehn indicated the future prospects for the entire field. Audience: Ph.D. students and young researchers in chemistry, physics and biology.
Author: Fritz V?gtle
Publisher: Wiley
ISBN: 9780471940616
Category : Science
Languages : en
Pages : 352
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Book Description
Supramolecular Chemistry F. Vögtle, Institut für Organische Chemie und Biochemie der Universität Bonn, Germany This book consists of twelve self-contained chapters on supramolecular structures. Using numerous examples of ‘aggregates’, the chemistry involved is described from different angles. Here, the multidisciplinary aspect of this domain of chemistry becomes apparent, as the close relationships with physics, physical chemistry, materials science and biochemistry are emphasized. The book begins with simple complex-forming compounds and ends with complex ‘supramolecules’ and ‘suprastructures’. One of the practicalities of this volume is the inclusion of many stereoscopic views of supramolecular structures, most of them based on X-ray crystallography.
Author: Hans-Jörg Schneider
Publisher: CRC Press
ISBN: 1439840148
Category : Medical
Languages : en
Pages : 457
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Book Description
Applications of Supramolecular Chemistry introduces the use of non-covalent interactions and molecular recognition for many fields. Applications include the analysis of technically, medically, and environmentally important chemical compounds, their separation, purification and removal, and the design of new materials, including supramolecular electronics. The book also explores biological interactions and applications in the food and textile industries.
