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Advances In Mathematical Chemistry And Applications

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Advances in Mathematical Chemistry and Applications

Advances in Mathematical Chemistry and Applications  Book
Author : Subhash C. Basak,Guillermo Restrepo,Jose L. Villaveces
Publisher : Elsevier
Release : 2016-02-11
ISBN : 1681080524
Language : En, Es, Fr & De

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Book Description :

Advances in Mathematical Chemistry and Applications highlights the recent progress in the emerging discipline of discrete mathematical chemistry. Editors Subhash C. Basak, Guillermo Restrepo, and Jose Luis Villaveces have brought together 27 chapters written by 68 internationally renowned experts in these two volumes. Each volume comprises a wise integration of mathematical and chemical concepts and covers numerous applications in the field of drug discovery, bioinformatics, chemoinformatics, computational biology, mathematical proteomics, and ecotoxicology. Volume 2 explores deeper the topics introduced in Volume 1, with numerous additional topics such as topological approaches for classifying fullerene isomers; chemical reaction networks; discrimination of small molecules using topological molecular descriptors; GRANCH methods for the mathematical characterization of DNA, RNA and protein sequences; linear regression methods and Bayesian techniques; in silico toxicity prediction methods; drug design; integration of bioinformatics and systems biology, molecular docking, and molecular dynamics; metalloenzyme models; protein folding models; molecular periodicity; generalized topologies and their applications; and many more. Brings together both the theoretical and practical aspects of the fundamental concepts of mathematical chemistry Covers applications in diverse areas of physics, chemistry, drug discovery, predictive toxicology, systems biology, chemoinformatics, and bioinformatics About half of the book focuses primarily on current work, new applications, and emerging approaches for the mathematical characterization of essential aspects of molecular structure, while the other half describes applications of structural approach to new drug discovery, virtual screening, protein folding, predictive toxicology, DNA structure, and systems biology

Advances in Mathematical Chemistry and Applications

Advances in Mathematical Chemistry and Applications  Book
Author : Subhash C. Basak,Guillermo Restrepo,Jose L. Villaveces
Publisher : Elsevier
Release : 2016-02-11
ISBN : 1681081970
Language : En, Es, Fr & De

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Book Description :

Advances in Mathematical Chemistry and Applications highlights the recent progress in the emerging discipline of discrete mathematical chemistry. Editors Subhash C. Basak, Guillermo Restrepo, and Jose Luis Villaveces have brought together 27 chapters written by 68 internationally renowned experts in these two volumes. Each volume comprises a wise integration of mathematical and chemical concepts and covers numerous applications in the field of drug discovery, bioinformatics, chemoinformatics, computational biology, mathematical proteomics, and ecotoxicology. Volume 1 includes chapters on mathematical structural descriptors of molecules and biomolecules, applications of partially ordered sets (posets) in chemistry, optimal characterization of molecular complexity using graph theory, different connectivity matrices and their polynomials, use of 2D fingerprints in similarity-based virtual screening, mathematical approaches to molecular structure generation, comparability graphs, applications of molecular topology in drug design, density functional theory of chemical reactivity, application of mathematical descriptors in the quantification of drug-likeness, utility of pharmacophores in drug design, and much more. Brings together both the theoretical and practical aspects of the fundamental concepts of mathematical chemistry Covers applications in diverse areas of physics, chemistry, drug discovery, predictive toxicology, systems biology, chemoinformatics, and bioinformatics Revised 2015 edition includes a new chapter on the current landscape of hierarchical QSAR modelling About half of the book focuses primarily on current work, new applications, and emerging approaches for the mathematical characterization of essential aspects of molecular structure, while the other half describes applications of structural approach to new drug discovery, virtual screening, protein folding, predictive toxicology, DNA structure, and systems biology

Fulltext Sources Online

Fulltext Sources Online Book
Author : Anonim
Publisher : Unknown
Release : 2004
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

Download Fulltext Sources Online book written by , available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.

Chemical Graph Theory

Chemical Graph Theory Book
Author : Nenad Trinajstic
Publisher : Routledge
Release : 2018-05-11
ISBN : 1351461567
Language : En, Es, Fr & De

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Book Description :

Chemical Graph Theory, 2nd Edition is a completely revised and updated edition of a highly regarded book that has been widely used since its publication in 1983. This unique book offers a basic introduction to the handling of molecular graphs - mathematical diagrams representing molecular structures. Using mathematics well within the vocabulary of most chemists, this volume elucidates the structural aspects of chemical graph theory: (1) the relationship between chemical and graph-theoretical terminology, elements of graph theory, and graph-theoretical matrices; (2) the topological aspects of the Hückel theory, resonance theory, and theories of aromaticity; and (3) the applications of chemical graph theory to structure-property and structure-activity relationships and to isomer enumeration. An extensive bibliography covering the most relevant advances in theory and applications is one of the book's most valuable features. This volume is intended to introduce the entire chemistry community to the applications of graph theory and will be of particular interest to theoretical organic and inorganic chemists, physical scientists, computational chemists, and those already involved in mathematical chemistry.

Advances in Teaching Physical Chemistry

Advances in Teaching Physical Chemistry Book
Author : Mark David Ellison,Tracy A. Schoolcraft
Publisher : Amer Chemical Society
Release : 2008
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

This book brings together the latest perspectives and ideas on teaching modern physical chemistry. It includes perspectives from experienced and well-known physical chemists, a thorough review of the education literature pertaining to physical chemistry, a thorough review of advances in undergraduate laboratory experiments from the past decade, in-depth descriptions of using computers to aid student learning, and innovative ideas for teaching the fundamentals of physical chemistry. This book will provide valuable insight and information to all teachers of physical chemistry.

Mathematical Analysis and Applications II

Mathematical Analysis and Applications II Book
Author : Hari M. Srivastava
Publisher : MDPI
Release : 2020-03-19
ISBN : 3039283847
Language : En, Es, Fr & De

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Book Description :

This issue is a continuation of the previous successful Special Issue “Mathematical Analysis and Applications” . Investigations involving the theory and applications of mathematical analytical tools and techniques are remarkably widespread in many diverse areas of the mathematical, physical, chemical, engineering and statistical sciences. In this Special Issue, we invite and welcome review, expository and original research articles dealing with the recent advances in mathematical analysis and its multidisciplinary applications.

Recent Advances in Mathematical and Statistical Methods

Recent Advances in Mathematical and Statistical Methods Book
Author : D. Marc Kilgour,Herb Kunze,Roman Makarov,Roderick Melnik,Xu Wang
Publisher : Springer
Release : 2018-11-04
ISBN : 331999719X
Language : En, Es, Fr & De

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Book Description :

This book focuses on the recent development of methodologies and computation methods in mathematical and statistical modelling, computational science and applied mathematics. It emphasizes the development of theories and applications, and promotes interdisciplinary endeavour among mathematicians, statisticians, scientists, engineers and researchers from other disciplines. The book provides ideas, methods and tools in mathematical and statistical modelling that have been developed for a wide range of research fields, including medical, health sciences, biology, environmental science, engineering, physics and chemistry, finance, economics and social sciences. It presents original results addressing real-world problems. The contributions are products of a highly successful meeting held in August 2017 on the main campus of Wilfrid Laurier University, in Waterloo, Canada, the International Conference on Applied Mathematics, Modeling and Computational Science (AMMCS-2017). They make this book a valuable resource for readers interested not only in a broader overview of the methods, ideas and tools in mathematical and statistical approaches, but also in how they can attain valuable insights into problems arising in other disciplines.

Advances in Chemical Engineering

Advances in Chemical Engineering Book
Author : Anonim
Publisher : Academic Press
Release : 2009-06-29
ISBN : 9780080912011
Language : En, Es, Fr & De

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Book Description :

The cross-fertilization of physico-chemical and mathematical ideas has a long historical tradition. This volume of Advances in Chemical Engineering is almost completely dedicated to a conference on “Mathematics in Chemical Kinetics and Engineering (MaCKiE-2007), which was held in Houston in February 2007, bringing together about 40 mathematicians, chemists, and chemical engineers from 10 countries to discuss the application and development of mathematical tools in their respective fields. * Updates and informs the reader on the latest research findings using original reviews * Written by leading industry experts and scholars * Reviews and analyzes developments in the field

Advances in Molecular Similarity

Advances in Molecular Similarity Book
Author : R. Carbó-Dorca,P.G. Mezey
Publisher : Elsevier
Release : 1999-02-18
ISBN : 9780080552262
Language : En, Es, Fr & De

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Book Description :

This volume highlights some of the advances in molecular similarity. Molecular similarity research is a dynamic field where the rapid transfer of ideas and methodologies from the theoretical, quantum chemical and mathematical chemistry disciplines to efficient algorithms and computer programs used in industrially important applications is especially evident. These applications often serve as motivating factors toward new advances in the fundamental and theoretical fields, and the combination of intellectual challenge and practical utility provides mutual advantages to theoreticians and experimentalists. The aim of this volume is to present an overview of the current methodologies of molecular similarity studies, and to point out new challenges, unsolved problems, and areas where important new advances can be expected.

Advances in Physical Organic Chemistry

Advances in Physical Organic Chemistry Book
Author : John P. Richard
Publisher : Academic Press
Release : 2011-09-12
ISBN : 0123860482
Language : En, Es, Fr & De

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Book Description :

Advances in Physical Organic Chemistry provides the chemical community with authoritative and critical assessments of the many aspects of physical organic chemistry. The field is a rapidly developing one, with results and methodologies finding application from biology to solid state physics. Reviews the application of quantitative and mathematical methods towards understanding chemical problems Covers organic, organometallic, bioorganic, enzymes and materials topics

Mathematical Physics in Theoretical Chemistry

Mathematical Physics in Theoretical Chemistry Book
Author : S. M. Blinder,J. E. House
Publisher : Elsevier
Release : 2018-11-26
ISBN : 0128137010
Language : En, Es, Fr & De

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Book Description :

Mathematical Physics in Theoretical Chemistry deals with important topics in theoretical and computational chemistry. Topics covered include density functional theory, computational methods in biological chemistry, and Hartree-Fock methods. As the second volume in the Developments in Physical & Theoretical Chemistry series, this volume further highlights the major advances and developments in research, also serving as a basis for advanced study. With a multidisciplinary and encompassing structure guided by a highly experienced editor, the series is designed to enable researchers in both academia and industry stay abreast of developments in physical and theoretical chemistry. Brings together the most important aspects and recent advances in theoretical and computational chemistry Covers computational methods for small molecules, density-functional methods, and computational chemistry on personal and quantum computers Presents cutting-edge developments in theoretical and computational chemistry that are applicable to graduate students and research professionals in chemistry, physics, materials science and biochemistry

Advances in Quantum Chemistry

Advances in Quantum Chemistry Book
Author : John R. Sabin,Erkki J. Brandas
Publisher : Academic Press
Release : 2008-05-15
ISBN : 9780123743350
Language : En, Es, Fr & De

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Book Description :

Advances in Quantum Chemistry presents surveys of current developments in this rapidly developing field that falls between the historically established areas of mathematics, physics, chemistry, and biology. With invited reviews written by leading international researchers, each presenting new results, it provides a single vehicle for following progress in this interdisciplinary area. Theoretical methods have dramatically extended the reach and grasp of atmospheric scientists. This edition of Advances in Quantum Chemistry collects a broad range of articles that provide reports from the leading edge of this interaction. The chemical systems span the range from atoms to clusters to droplets. Electronic structure calculations are used to uncover the details of the breakdown and removal of emissions from the atmosphere and the simultaneous development of air pollution including ozone and particles. The anomalous enrichment of heavy isotopes in atmospheric ozone is discussed using RRKM theory, and a number of techniques are presented for calculating the effect of isotopic substitution on the absorption spectra of atmospheric molecules. * Publishes articles, invited reviews and proceedings of major international conferences and workshops * Written by leading international researchers in quantum and theoretical chemistry * Highlights important interdisciplinary developments

Advances in Quantum Chemistry

Advances in Quantum Chemistry Book
Author : Anonim
Publisher : Academic Press
Release : 2013-07-23
ISBN : 0124079067
Language : En, Es, Fr & De

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Book Description :

Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. This volume focuses on the theory of heavy ion physics in medicine. Presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology Features detailed reviews written by leading international researchers Focuses on the theory of heavy ion physics in medicine

Advances in Mathematical Modeling and Simulation of Electrochemical Processes and Oxygen Depolarized Cathodes and Activated Cathodes for Chlor alkali and Chlorate Processes

Advances in Mathematical Modeling and Simulation of Electrochemical Processes and Oxygen Depolarized Cathodes and Activated Cathodes for Chlor alkali and Chlorate Processes Book
Author : Electrochemical Society. Industrial Electrolysis and Electrochemical Engineering Division,Electrochemical Society. Energy Technology Division,Electrochemical Society. Meeting
Publisher : The Electrochemical Society
Release : 1998
ISBN : 9781566772044
Language : En, Es, Fr & De

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Book Description :

Download Advances in Mathematical Modeling and Simulation of Electrochemical Processes and Oxygen Depolarized Cathodes and Activated Cathodes for Chlor alkali and Chlorate Processes book written by Electrochemical Society. Industrial Electrolysis and Electrochemical Engineering Division,Electrochemical Society. Energy Technology Division,Electrochemical Society. Meeting, available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.

Knots and Applications

Knots and Applications Book
Author : Louis H. Kauffman
Publisher : World Scientific
Release : 1995
ISBN : 9789810220044
Language : En, Es, Fr & De

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Book Description :

This volume is a collection of research papers devoted to the study of relationships between knot theory and the foundations of mathematics, physics, chemistry, biology and psychology. Included are reprints of the work of Lord Kelvin (Sir William Thomson) on the 19th century theory of vortex atoms, reprints of modern papers on knotted flux in physics and in fluid dynamics and knotted wormholes in general relativity. It also includes papers on Witten's approach to knots via quantum field theory and applications of this approach to quantum gravity and the Ising model in three dimensions. Other papers discuss the topology of RNA folding in relation to invariants of graphs and Vassiliev invariants, the entanglement structures of polymers, the synthesis of molecular Mobius strips and knotted molecules. The book begins with an article on the applications of knot theory to the foundations of mathematics and ends with an article on topology and visual perception. This volume will be of immense interest to all workers interested in new possibilities in the uses of knots and knot theory.

Mathematical Reviews

Mathematical Reviews Book
Author : Anonim
Publisher : Unknown
Release : 2001
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

Download Mathematical Reviews book written by , available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.

New Trends in Chemical Physics Research

New Trends in Chemical Physics Research Book
Author : James N. Lapherty
Publisher : Nova Science Pub Incorporated
Release : 2011
ISBN : 9781616685355
Language : En, Es, Fr & De

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Book Description :

This book presents and discusses recent research developments in the field of chemical physics. Topics discussed herein include quantum dynamics in base pair DNA systems; chemical physical properties of bioprotectant-biomolecule systems; chemical physics of phonons; optimisation of polar solar cells; computer molecular modelling; wood pyrolysis; and phonon dynamics of fe-based glassy alloys.

Periodical Title and Abbreviation by Abbreviation

Periodical Title and Abbreviation by Abbreviation Book
Author : Leland G. Alkire,Cheryl Westerman-Alkire
Publisher : Gale Group
Release : 2005
ISBN : 9780787699185
Language : En, Es, Fr & De

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Book Description :

Volume 1 is a comprehensive dictionary with more than 230,000 entries. It covers periodicals from a wide variety of subjects, including: science, social sciences, humanities, law, medicine, religion, library science, engineering, education, business, and art. Volume 1lists, in a single in letter-by-letter sequence, abbreviations commonly used for periodicals together with their full titles.

New Scientist

New Scientist Book
Author : Anonim
Publisher : Unknown
Release : 1988
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

Download New Scientist book written by , available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.

AIChE Symposium Series

AIChE Symposium Series Book
Author : American Institute of Chemical Engineers
Publisher : Unknown
Release : 1983
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

Download AIChE Symposium Series book written by American Institute of Chemical Engineers, available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.