Modern Electronic Structure Theory

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Publisher : World Scientific
ISBN 13 : 9812832114
Total Pages : 785 pages
Book Rating : 4.8/5 (128 download)

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Book Synopsis Modern Electronic Structure Theory by : D. R. Yarkony

Download or read book Modern Electronic Structure Theory written by D. R. Yarkony and published by World Scientific. This book was released on 1995 with total page 785 pages. Available in PDF, EPUB and Kindle. Book excerpt: Modern Electronic Structure Theory provides a didactically oriented description of the latest computational techniques in electronic structure theory and their impact in several areas of chemistry. The book is aimed at first year graduate students or college seniors considering graduate study in computational chemistry, or researchers who wish to acquire a wider knowledge of this field.

Pandex Current Index to Scientific and Technical Literature

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Publisher :
ISBN 13 :
Total Pages : 1068 pages
Book Rating : 4.F/5 ( download)

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Book Synopsis Pandex Current Index to Scientific and Technical Literature by :

Download or read book Pandex Current Index to Scientific and Technical Literature written by and published by . This book was released on 1971 with total page 1068 pages. Available in PDF, EPUB and Kindle. Book excerpt:

A New Dimension to Quantum Chemistry

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Publisher : Oxford University Press, USA
ISBN 13 :
Total Pages : 500 pages
Book Rating : 4.3/5 (91 download)

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Book Synopsis A New Dimension to Quantum Chemistry by : Yukio Yamaguchi

Download or read book A New Dimension to Quantum Chemistry written by Yukio Yamaguchi and published by Oxford University Press, USA. This book was released on 1994 with total page 500 pages. Available in PDF, EPUB and Kindle. Book excerpt: In modern theoretical chemistry, the importance of the analytic evaluation of energy derivatives from reliable wave functions can hardly be overestimated. This monograph presents the formulation and implementation of analytical energy derivative methods in ab initio quantum chemistry. It includes a systematic presentation of the necessary algebraic formulae for all of the derivations. The coverage is limited to derivative methods for wave functions based on the variational principle, namely restricted Hartree-Fock (RHF), configuration interaction (CI) and multi-configuration self-consistent-field (MCSCF) wave functions. The monograph is intended to facilitate the work of quantum chemists, and will serve as a useful resource for graduate-level students of the field.

Modern Tools for the Synthesis of Complex Bioactive Molecules

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Publisher : John Wiley & Sons
ISBN 13 : 9780470616185
Total Pages : 0 pages
Book Rating : 4.6/5 (161 download)

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Book Synopsis Modern Tools for the Synthesis of Complex Bioactive Molecules by : Janine Cossy

Download or read book Modern Tools for the Synthesis of Complex Bioactive Molecules written by Janine Cossy and published by John Wiley & Sons. This book was released on 2012-10-09 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: All the latest tools needed to plan and perform the synthesis of complex bioactive molecules Focusing on organic, organometallic, and bio-oriented processes, this book explores the impact and use of the latest synthetic tools for the synthesis of complex biologically active compounds. Readers will discover step by step how these synthetic tools have provided new, elegant solutions to many synthetic puzzles. Moreover, they will discover innovative methods that make it possible to control the exact connectivity of atoms within a molecule in order to set precise three-dimensional arrangements. Modern Tools for the Synthesis of Complex Bioactive Molecules features sixteen chapters, each one written by one or more leading experts in organic synthesis from around the world. It covers a broad range of topics that enable readers to take advantage of the latest methods for synthesizing complex molecules, including: Modern catalysis, emphasizing key transformations such as C-H functionalizations, cross-couplings, gold-catalyzed reactions, metathesis-based syntheses, and asymmetric organocatalysis Eco-compatible transformations, including rearrangements and domino reactions Tools for the synthesis of carbohydrates and alkaloids New techniques, including the use of fluorous tags and engineered biosynthesis The last two chapters explore target- and diversity-oriented organic synthesis as well as the use of DNA-based asymmetric catalysis, which are all promising tools for the successful synthesis of complex bioactive molecules. Modern Tools for the Synthesis of Complex Bioactive Molecules is ideal for students and researchers who need to plan and perform the synthesis of complex molecules as efficiently as possible. The book's expert advice will help these readers quickly resolve a broad range of problems that can arise in organic syntheses.

Reactions and Syntheses

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Publisher : John Wiley & Sons
ISBN 13 : 3527338144
Total Pages : 667 pages
Book Rating : 4.5/5 (273 download)

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Book Synopsis Reactions and Syntheses by : Lutz F. Tietze

Download or read book Reactions and Syntheses written by Lutz F. Tietze and published by John Wiley & Sons. This book was released on 2015-06-22 with total page 667 pages. Available in PDF, EPUB and Kindle. Book excerpt: The second edition of this classic text book has been completely revised, updated, and extended to include chapters on biomimetic amination reactions, Wacker oxidation, and useful domino reactions. The first-class author team with long-standing experience in practical courses on organic chemistry covers a multitude of preparative procedures of reaction types and compound classes indispensable in modern organic synthesis. Throughout, the experiments are accompanied by the theoretical and mechanistic fundamentals, while the clearly structured sub-chapters provide concise background information, retrosynthetic analysis, information on isolation and purification, analytical data as well as current literature citations. Finally, in each case the synthesis is labeled with one of three levels of difficulty. An indispensable manual for students and lecturers in chemistry, organic chemists, as well as lab technicians and chemists in the pharmaceutical and agrochemical industries.

Bioactive Heterocycles

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Publisher :
ISBN 13 :
Total Pages : pages
Book Rating : 4.:/5 (123 download)

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Book Synopsis Bioactive Heterocycles by :

Download or read book Bioactive Heterocycles written by and published by . This book was released on with total page pages. Available in PDF, EPUB and Kindle. Book excerpt:

Linear-Scaling Techniques in Computational Chemistry and Physics

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Publisher : Springer Science & Business Media
ISBN 13 : 9048128536
Total Pages : 522 pages
Book Rating : 4.0/5 (481 download)

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Book Synopsis Linear-Scaling Techniques in Computational Chemistry and Physics by : Robert Zaleśny

Download or read book Linear-Scaling Techniques in Computational Chemistry and Physics written by Robert Zaleśny and published by Springer Science & Business Media. This book was released on 2011-03-21 with total page 522 pages. Available in PDF, EPUB and Kindle. Book excerpt: "Linear-Scaling Techniques in Computational Chemistry and Physics" summarizes recent progresses in linear-scaling techniques and their applications in chemistry and physics. In order to meet the needs of a broad community of chemists and physicists, the book focuses on recent advances that extended the scope of possible exploitations of the theory. The first chapter provides an overview of the present state of the linear-scaling methodologies and their applications, outlining hot topics in this field, and pointing to expected developments in the near future. This general introduction is then followed by several review chapters written by experts who substantially contributed to recent developments in this field. The purpose of this book is to review, in a systematic manner, recent developments in linear-scaling methods and their applications in computational chemistry and physics. Great emphasis is put on the theoretical aspects of linear-scaling methods. This book serves as a handbook for theoreticians, who are involved in the development of new efficient computational methods as well as for scientists, who are using the tools of computational chemistry and physics in their research.