Download or read book Topological Approach to the Chemistry of Conjugated Molecules written by A. Graovac and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 131 pages. Available in PDF, EPUB and Kindle. Book excerpt: "The second step is to determine constitution, Le. which atoms are bonded to which and by what types of bond. The result is ex pressed by a planar graph (or the corresponding connectivity mat rix) •••• In constitutional formulae, the atoms are represented by letters and the bonds by lines. They describe the topology of the molecule." VLADIMIR PRELOG, Nobel Lecture, December l2;h 1975. In the present notes we describe the topological approach to the che mistry of conjugated molecules using graph-theoretical concepts. Con jugatedstructures may be conveniently studied using planar and connec ted graphs because they reflect in the simple way the connectivity of their pi-centers. Connectivity is important topological property of a molecule which allows a conceptual qualitative understanding, via a non numerical analysis, of many chemical phenomena or at least that part of phenomenon which depends on topology. This would not be possible sole ly by means of numerical (molecular orbital) analysis.
Download or read book Topological approach to the chemistry of conjugated molecules written by Ante Graovac and published by . This book was released on 1977 with total page 123 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Topological Approach to the Chemical of Conjugated Molecules written by Graovac, A and published by . This book was released on 1977 with total page 123 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Chemical Graph Theory written by Danail Bonchev and published by Taylor & Francis. This book was released on 1992 with total page 294 pages. Available in PDF, EPUB and Kindle. Book excerpt: Building on the background of graph theory provided in the first volume of the series, presents a detailed examination of the role of graph theory in the study of chemical kinetics, reaction mechanisms, and quantitative structure-activity relations, in a manner useful to theoretical chemists. Among the topics are heterogeneous catalytic reactions, the classification and coding of chemical reaction mechanisms, the mechanist's description of chemical processes as it relates to aromaticity, and using operator networks to interpret evolutionary interrelations between chemical entities. Annotation copyright by Book News, Inc., Portland, OR
Download or read book Analysis of Complex Networks written by Matthias Dehmer and published by John Wiley & Sons. This book was released on 2009-07-10 with total page 480 pages. Available in PDF, EPUB and Kindle. Book excerpt: Mathematical problems such as graph theory problems are of increasing importance for the analysis of modelling data in biomedical research such as in systems biology, neuronal network modelling etc. This book follows a new approach of including graph theory from a mathematical perspective with specific applications of graph theory in biomedical and computational sciences. The book is written by renowned experts in the field and offers valuable background information for a wide audience.
Download or read book Chemical Graph Theory written by D Bonchev and published by Taylor & Francis. This book was released on 2018-05-11 with total page 301 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume presents the fundamentals of graph theory and then goes on to discuss specific chemical applications. Chapter 1 provides a historical setting for the current upsurge of interest in chemical graph theory. Chapter 2 gives a full background of the basic ideas and mathematical formalism of graph theory and includes such chemically relevant notions as connectedness, graph matrix representations, metric properties, symmetry and operations on graphs. This is followed by a discussion on chemical nomenclature and the trends in its rationalization by using graph theory, which has important implications for the storage and retrieval of chemical information. This volume also contains a detailed discussion of the relevance of graph-theoretical polynomials; it describes methodologies for the enumeration of isomers, incorporating the classical Polya method, as well as more recent approaches.
Download or read book Handbook of Combinatorics written by R.L. Graham and published by Elsevier. This book was released on 1995-12-11 with total page 1283 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Theory of Coronoid Hydrocarbons II written by S.J. Cyvin and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 305 pages. Available in PDF, EPUB and Kindle. Book excerpt: The present monograph is a continuation of Cyvin SJ, Brunvoll J and Cyvin (1991c), a reference to be found in Bibliography. Naturally, the previous volume is cited frequently here. For the sake of brevity, it is referred to as "Volume I". References to different chapters, sections or paragraphs are given like Vol. 1-1, 1-1.2 or 1-1.2.2, respectively. Also tables and equations in "Volume I" are cited; the very last equation therein, for instance, is Vol. I-{9.9). The present text spans from references to organic syntheses or attempted organic syntheses - - to stringent mathematical theorems proved by graph-theoretical methods. Enumerations of coronoid systems is a substantial part of the work. Algebraic methods involving combinatorics and generating functions are employed on one hand, and computer programming on the other. The whole book is supposed to demonstrate a piece of mathematical chemistry, which can be characterized as lying on the "interfaces between mathematics, chemistry and computer science", a formulation used for the MATH/CHEM/COMP Conferences; d. Cyvin SJ, Brunvoll and Cyvin (1989d) in Bibliography. Financial support to BNC from the Norwegian Council for Science and the Humanities is gratefully acknowledged.
Download or read book Organic Synthesis with Palladium Compounds written by Jiro Tsuji and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 221 pages. Available in PDF, EPUB and Kindle. Book excerpt: Around 30 years ago the transition metal chemistry received great impulses. In the focus have been reactions of nickel and cobalt and herein especially their carbonyls. Also industrial processes have been developed. When the technical oxidation of ethylene with palladium chloride had been discovered, and a great number oflaboratory reactions, many groups have turned towards this subject. Apart from two important industrial processes - acetaldehyde and vinylacetate from ethylene - a great number of conversions and catalytic reactions with palladium compounds have been researched. Their mechanisms have been cleared up and have con tributed to a better understanding of the complex chemistry of palladium. Last but not least these reactions have also served for more understanding of organic transition metal compounds and catalyses in general. Numerous conventional reactions appear today in a different light. The effects of co-
Download or read book Advances in Heterocyclic Chemistry written by and published by Academic Press. This book was released on 1980-09-24 with total page 259 pages. Available in PDF, EPUB and Kindle. Book excerpt: Advances in Heterocyclic Chemistry
Download or read book Light Absorption of Organic Colorants written by J. Fabian and published by Springer Science & Business Media. This book was released on 2013-11-11 with total page 254 pages. Available in PDF, EPUB and Kindle. Book excerpt: Although studies on synthetic dyes have been performed for more than 100 years, their detailed elucidation requires further extensive research. The discovery of novel high polymers, the necessity of supplying a whole range of shades and increasing require ments for dyestuffs of high fastness properties give rise to a permanent search for new dyes. Extensive investigations on dyes were also occasioned by various applications in the field of spectral sensitization and of staining of biological specimens. Another more recent development concerns the lasing properties of some organic dyes. Most of the progress, however, was only achieved by time-consuming, purely empirical approaches and theoretical understanding of the dye properties is only at its very beginnings. The color is the sine qua non of every dye. For this reason organic chemists and color chemists have looked for relations between the "color and constitution" of dye molecules for a long time. This knowlege as a whole is known as "theory of color". The classic theory of color was established abou t 100 years ago by Witt and was signi ficantly extended 50 years later by W. Konig.
Download or read book Chemistry Reviews written by and published by CRC Press. This book was released on 1985 with total page 376 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Applications of Topological Methods in Molecular Chemistry written by Remi Chauvin and published by Springer. This book was released on 2016-04-19 with total page 582 pages. Available in PDF, EPUB and Kindle. Book excerpt: This is the first edited volume that features two important frameworks, Hückel and quantum chemical topological analyses. The contributors, which include an array of academics of international distinction, describe recent applications of such topological methods to various fields and topics that provide the reader with the current state-of-the-art and give a flavour of the wide range of their potentialities.
Download or read book Bulletin de la Soci t chimique Beograd written by and published by . This book was released on 1981 with total page 1746 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Overlap Determinant Method in the Theory of Pericyclic Reactions written by Robert Ponec and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 135 pages. Available in PDF, EPUB and Kindle. Book excerpt: The author summarizes the development and the applications of overlap determinant method in various fields of pericyclic reactivity. The greatest advantage of this new method lies in its remarkable simplicity and flexibility owing to which it opens an interesting possibility of the systematic investigation of important mechanistic problems of pericyclic reactivity which were so far beyond the scope of other existing techniques.
Download or read book Applied Linear Algebra Probability and Statistics written by Ravindra B. Bapat and published by Springer Nature. This book was released on 2023-07-31 with total page 540 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book focuses on research in linear algebra, statistics, matrices, graphs and their applications. Many chapters in the book feature new findings due to applications of matrix and graph methods. The book also discusses rediscoveries of the subject by using new methods. Dedicated to Prof. Calyampudi Radhakrishna Rao (C.R. Rao) who has completed 100 years of legendary life and continues to inspire us all and Prof. Arbind K. Lal who has sadly departed us too early, it has contributions from collaborators, students, colleagues and admirers of Professors Rao and Lal. With many chapters on generalized inverses, matrix analysis, matrices and graphs, applied probability and statistics, and the history of ancient mathematics, this book offers a diverse array of mathematical results, techniques and applications. The book promises to be especially rewarding for readers with an interest in the focus areas of applied linear algebra, probability and statistics.
Download or read book Steric Fit in Quantitative Structure Activity Relations written by A.T. Balaban and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 189 pages. Available in PDF, EPUB and Kindle. Book excerpt:
