Combinatorial and High-Throughput Discovery and Optimization of Catalysts and Materials

Combinatorial and High-Throughput Discovery and Optimization of Catalysts and Materials
Author: Radislav A. Potyrailo
Publisher: CRC Press
Total Pages: 504
Release: 2006-07-19
Genre: Science
ISBN: 1420005383

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The development of parallel synthesis and high-throughput characterization tools offer scientists a time-efficient and cost-effective solution for accelerating traditional synthesis processes and developing the structure-property relationships of multiple materials under variable conditions. Written by renowned contributors to the field, Combina

Combinatorial Chemistry

Combinatorial Chemistry
Author: Günther Jung
Publisher: John Wiley & Sons
Total Pages: 634
Release: 2008-07-11
Genre: Science
ISBN: 352761351X

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The story of success goes on and on - with a new book on combinatorial chemistry, edited by Gunther Jung! Combinatorial chemistry is a proven time- and resource-saving synthetic method of outstanding importance for industrial processes. Compound libraries help to save time and money, especially in the search for new drugs, and therefore play a pivotal role in solving the problem of the worldwide increasing demand for new and more active drugs. Not only substances, which are of interest for pharmaceutical chemistry, but also materials, catalysts, and biomolecules such as DNA or oligosaccharides are readily available with high structural diversities. The broad scope of combinatorial sciences is reflected by this book, edited by Gunther Jung: The synthetic methods discussed range from solid-phase to solution-phase synthesis, from preparations of small molecules such as amines or alcohols to those of complex biomolecules. Feasible methods, efficient techniques, new trends in automation, and state-of-the-art fast instrumental analytical and screening methods are presented with many practical tips and tricks for everybody working in combinatorial chemistry. This is the book written by specialists for specialists and for everyone aspiring to become an insider! It is an indispensible source of information for researchers working in organic synthesis, catalysis, biochemistry, and biotechnology, pharmaceutical and clinical chemistry, material sciences, and analytical chemistry.

Combinatorial Catalysis and High Throughput Catalyst Design and Testing

Combinatorial Catalysis and High Throughput Catalyst Design and Testing
Author: E.G. Derouane
Publisher: Springer Science & Business Media
Total Pages: 497
Release: 2012-12-06
Genre: Science
ISBN: 9401143293

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Catalysts are central in modern industrial chemistry and there is an urgent need to develop new catalysts. Such a rapid pace of development brings with it a new set of challenges at all levels of research, from synthesis and characterization to testing and modelling. This book reviews the current status of combinatorial catalysis, scientific catalyst design techniques, methods for preparing inorganic combinatorial libraries, experimental design methods, data processing, system modelling an simulation, and catalyst testing. The individual contributions reveal the development of high throughput catalyst design and test methods and identify the main challenges in the field, including new catalyst preparation techniques, rapid performance evaluation, and new microreactor configurations. Readership: All those working in catalytic process analysis and development. The extensive review of catalysis principles is especially relevant for postgraduate students seeking to pursue studies in catalysis.

Modern Applications of High Throughput R&D in Heterogeneous Catalysis

Modern Applications of High Throughput R&D in Heterogeneous Catalysis
Author: Alfred Hagemeyer
Publisher: Bentham Science Publishers
Total Pages: 404
Release: 2014-04-04
Genre: Science
ISBN: 1608058727

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This eBook covers the application of high-throughput R&D to both fundamental and applied catalysis including catalyst synthesis, characterization, and testing in various reactor types. Chapters include topics such as applications ranging from optimizations of established industrial catalysts to the discovery of innovative new materials, examples of the development of innovative parallel characterization methods, and cases of real catalyst testing in small scale reactor systems. Readers will also find chapters that cover commodity chemicals produced using continuous gas phase processes as well as fine chemicals produced in liquid phase batch reactors. The potential of industrial chemicals production from biorenewable feedstocks is also presented. The steadily improving high throughput workflows are today being applied to relevant reactions and targets such as hydrotreating, Deacon oxidation, Fischer-Tropsch, propane dehydrogenation, C4 oxidation, methane coupling, exhaust gas catalysis, bio-based Nylon, fuel cells and vitamins. The topics presented in this eBook have been contributed by researchers from academia as well as industry, making this eBook a well-balanced reference, which could be of particular interest to professional, industrial or service R&D labs.

Combinatorial Development of Solid Catalytic Materials

Combinatorial Development of Solid Catalytic Materials
Author: Manfred Baerns
Publisher: World Scientific
Total Pages: 191
Release: 2009
Genre: Computers
ISBN: 1848163444

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The book provides a comprehensive treatment of combinatorial development of heterogeneous catalysts. In particular, two computer-aided approaches that have played a key role in combinatorial catalysis and high-throughput experimentation during the last decade OCo evolutionary optimization and artificial neural networks OCo are described. The book is unique in that it describes evolutionary optimization in a broader context of methods of searching for optimal catalytic materials, including statistical design of experiments, as well as presents neural networks in a broader context of data analysis. It is the first book that demystifies the attractiveness of artificial neural networks, explaining its rational fundamental OCo their universal approximation capability. At the same time, it shows the limitations of that capability and describes two methods for how it can be improved. The book is also the first that presents two other important topics pertaining to evolutionary optimization and artificial neural networks: automatic generating of problem-tailored genetic algorithms, and tuning evolutionary algorithms with neural networks. Both are not only theoretically explained, but also well illustrated through detailed case studies. Sample Chapter(s). Chapter 1: Background of Combinatorial Catalyst Development (63 KB). Contents: Background of Combinatorial Catalyst Development (M Baerns); Approaches in the Development of Heterogeneous Catalysts (M Baerns); Mathematical Methods of Searching for Optimal Catalytic Materials (M Holena); Generating Problem-Tailored Genetic Algorithms for Catalyst Search (M Holena); Analysis and Mining of Data Collected in Catalytic Experiments (M Holena); Artificial Neural Networks in the Development of Catalytic Materials (M Holena); Tunning Evolutionary Algorithms with Artificial Neural Networks (M Holena); Improving Neural Network Approximations (M Holena); Applications of Combinatorial Catalyst Development and An Outlook on Future Work (M Baerns). Readership: Chemists and chemical engineers from academia and industry working in catalysis; materials scientists; graduate students dealing with catalytic chemistry interested in computer-aided methods.

Combinatorial Chemistry and Technologies

Combinatorial Chemistry and Technologies
Author: Stanislav Miertus
Publisher: CRC Press
Total Pages: 616
Release: 2005-04-12
Genre: Medical
ISBN: 0824758374

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Several books on the market cover combinatorial techniques, but they offer just a limited perspective of the field, focusing on selected aspects without examining all approaches and integrated technologies. Combinatorial Chemistry and Technologies: Methods and Applications answers the demand for a complete overview of the field, covering all of the methodologies used in the design, synthesis, and screening of molecular libraries. Now in its second edition, this volume updates prior content and explores new areas such as catalysis, applications in biotechnology, and current ICS-UNIDO activities. Topics include the generation of molecular diversity by chemical methods using solution- and solid-phase chemistries, biological approaches for the production and screening of peptides, antibody and oligonucleotide libraries, and the application of computer-assisted approaches to guide library synthesis. The book establishes the link between combinatorial chemistry and molecular modeling and illustrates the importance of economics and patenting in combinatorial technologies. Valuable to technologists and researchers as an introductory survey on the many aspects of combinatorial chemistry and combinatorial technology, Combinatorial Chemistry and Technologies: Methods and Applications offers an overview of a field that promises broad applicability in the identification of new drugs, as well as in diagnostics, new materials, and catalysis.

Combinatorial Chemistry

Combinatorial Chemistry
Author: Willi Bannwarth
Publisher: John Wiley & Sons
Total Pages: 694
Release: 2006-05-12
Genre: Science
ISBN: 3527607382

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The new edition of this practice-oriented handbook features thoroughly updated contents, including recent developments in parallel synthesis. A new chapter on screening complements the overview of combinatorial strategy and synthetic methods. "Experimental details and complete reaction data [...] are a constant theme running through this work" (Angewandte Chemie) "Recommended to newcomers in the field of combinatorial chemical synthesis because of its broad scope" (Journal of the American Chemical Society)

Optimization of Solid-Phase Combinatorial Synthesis

Optimization of Solid-Phase Combinatorial Synthesis
Author: Bing Yan
Publisher: CRC Press
Total Pages: 408
Release: 2001-12-04
Genre: Science
ISBN: 9780824706548

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"Addresses the key topic in combinatorial synthesis--how to optimize the quality of a combinatorial library--by determining the usefulness of synthesized compunds, the reliability of biological assay results, and analyzing acadmic and industrial applications, real-world examples, and case studies of successful and unsuccessful technologies."

High-Throughput Screening in Chemical Catalysis

High-Throughput Screening in Chemical Catalysis
Author: Alfred Hagemeyer
Publisher: John Wiley & Sons
Total Pages: 341
Release: 2006-03-06
Genre: Science
ISBN: 3527604308

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In this first book to present every important aspect of this fascinating and developing field, the three editors A. Hagemeyer, P. Strasser and A. F. Volpe Jr. from Symyx Technologies have chosen a perfect mixture of distinguished, international authors from both academia and industry. Each chapter is devoted to a major topic - high-throughput experimentation methodologies, integrated combinatorial synthesis and screening workflow, and applications to chemical catalysts with an emphasis on heterogeneous catalysis, olefin polymerization and electrocatalysis for fuel cells. An indispensable source for everyone working in the field.