Correlation Analysis in Chemistry

Correlation Analysis in Chemistry
Author: N. Chapman
Publisher: Springer Science & Business Media
Total Pages: 557
Release: 2012-12-06
Genre: Science
ISBN: 1461588316

This book, Correlation Analysis in Chemistry: Recent Advances, is a sequel to our Advances in Linear Free Energy Relationships. t The change in the title is designed to reflect more accurately the nature of the field and the contents of the volume. The term LFER is still widely used, but it is often applied rather loosely to correlation equations that are not LFER in the restricted sense of a relationship involving logarithms of rate or equili brium constants on each side of the equation. The term "correlation analysis" seems to us more appropriate for the whole subject. The use of this term has compelled us also to introduce "chemistry" into the title; we have preferred not to prefix this with "organic" on the grounds that several areas of interest are not "organic chemistry" as usually understood, al though, of course, traditional applications of the basic relationships asso ciated with the names of Hammett and of Taft continue to be of interest. In the first volume we sought through our authors to provide a series of general articles covering the various aspects of the field as they seemed to us. Since the book was the first international research monograph in its field, each chapter, while giving prominence to recent developments, did not neglect earlier work, so that each article presented a comprehensive account of its own area.

March's Advanced Organic Chemistry

March's Advanced Organic Chemistry
Author: Michael B. Smith
Publisher: John Wiley & Sons
Total Pages: 2146
Release: 2020-02-19
Genre: Science
ISBN: 1119371805

The completely revised and updated, definitive resource for students and professionals in organic chemistry The revised and updated 8th edition of March's Advanced Organic Chemistry: Reactions, Mechanisms, and Structure explains the theories of organic chemistry with examples and reactions. This book is the most comprehensive resource about organic chemistry available. Readers are guided on the planning and execution of multi-step synthetic reactions, with detailed descriptions of all the reactions The opening chapters of March's Advanced Organic Chemistry, 8th Edition deal with the structure of organic compounds and discuss important organic chemistry bonds, fundamental principles of conformation, and stereochemistry of organic molecules, and reactive intermediates in organic chemistry. Further coverage concerns general principles of mechanism in organic chemistry, including acids and bases, photochemistry, sonochemistry and microwave irradiation. The relationship between structure and reactivity is also covered. The final chapters cover the nature and scope of organic reactions and their mechanisms. This edition: Provides revised examples and citations that reflect advances in areas of organic chemistry published between 2011 and 2017 Includes appendices on the literature of organic chemistry and the classification of reactions according to the compounds prepared Instructs the reader on preparing and conducting multi-step synthetic reactions, and provides complete descriptions of each reaction The 8th edition of March's Advanced Organic Chemistry proves once again that it is a must-have desktop reference and textbook for every student and professional working in organic chemistry or related fields. Winner of the Textbook & Acadmic Authors Association 2021 McGuffey Longevity Award.

Chemoinformatics

Chemoinformatics
Author: Johann Gasteiger
Publisher: John Wiley & Sons
Total Pages: 680
Release: 2006-12-13
Genre: Science
ISBN: 3527606505

This first work to be devoted entirely to this increasingly important field, the "Textbook" provides both an in-depth and comprehensive overview of this exciting new area. Edited by Johann Gasteiger and Thomas Engel, the book provides an introduction to the representation of molecular structures and reactions, data types and databases/data sources, search methods, methods for data analysis as well as such applications as structure elucidation, reaction simulation, synthesis planning and drug design. A "hands-on" approach with step-by-step tutorials and detailed descriptions of software tools and Internet resources allows easy access for newcomers, advanced users and lecturers alike. For a more detailed presentation, users are referred to the "Handbook of Chemoinformatics", which will be published separately. Johann Gasteiger is the recipient of the 1991 Gmelin-Beilstein Medal of the German Chemical Society for Achievements in Computer Chemistry, and the Herman Skolnik Award of the Division of Chemical Information of the American Chemical Society (ACS) in 1997. Thomas Engel joined the research group headed by Johann Gasteiger at the University of Erlangen-Nuremberg and is a specialist in chemoinformatics.

An Introduction to Applied Multivariate Analysis with R

An Introduction to Applied Multivariate Analysis with R
Author: Brian Everitt
Publisher: Springer Science & Business Media
Total Pages: 284
Release: 2011-04-23
Genre: Mathematics
ISBN: 1441996508

The majority of data sets collected by researchers in all disciplines are multivariate, meaning that several measurements, observations, or recordings are taken on each of the units in the data set. These units might be human subjects, archaeological artifacts, countries, or a vast variety of other things. In a few cases, it may be sensible to isolate each variable and study it separately, but in most instances all the variables need to be examined simultaneously in order to fully grasp the structure and key features of the data. For this purpose, one or another method of multivariate analysis might be helpful, and it is with such methods that this book is largely concerned. Multivariate analysis includes methods both for describing and exploring such data and for making formal inferences about them. The aim of all the techniques is, in general sense, to display or extract the signal in the data in the presence of noise and to find out what the data show us in the midst of their apparent chaos. An Introduction to Applied Multivariate Analysis with R explores the correct application of these methods so as to extract as much information as possible from the data at hand, particularly as some type of graphical representation, via the R software. Throughout the book, the authors give many examples of R code used to apply the multivariate techniques to multivariate data.

Contemporary Topics in Analytical and Clinical Chemistry

Contemporary Topics in Analytical and Clinical Chemistry
Author: David Hercules
Publisher: Springer Science & Business Media
Total Pages: 315
Release: 2013-03-09
Genre: Science
ISBN: 1461567343

1. Surface Characterization of Biological Materials by X-Ray Photoelectron Spectroscopy.- 2. Surface Analysis using Energetic Ions.- 3. A Synergic Approach to Graduate Research in Spectroscopy and Spectrochemical Analysis.- 4. Correlation Methods in Chemical Data Measurement.- 5. Signal-to-Noise Ratios in Mass Spectroscopic Ion-Current-Measurement Systems.- 6. Analytical Techniques for the Study of Biological Membranes.

The Chemistry of the Hydrazo, Azo and Azoxy Groups, Volume 2

The Chemistry of the Hydrazo, Azo and Azoxy Groups, Volume 2
Author: Saul Patai
Publisher: John Wiley & Sons
Total Pages: 839
Release: 1997-12-29
Genre: Science
ISBN: 0471968854

The first volume of The Chemistry of the Hydrazo, Azo and Azoxy Groups was published in 1975 in two parts, and the present book is the second volume of this publication. Since 1975 three supplementary volumes dealing with the chemistry of double-bonded functional groups were also published in the Series and these volumes contain much material on the chemistry of azoxy compounds. Several subjects were omitted from the original volume in 1975. These omissions have been corrected in the present volume, which contains chapters on "Detection, identification and determination," on NMR, on ESR, on PES, on pharmacology and toxicology, and also on safety and environmental factors.