R for Quantitative Chemistry

David K. Gosser (City College, City University of New York)

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English

Chapman & Hall/CRC
31 August 2023

Environmental medicine; Probability & statistics; Analytical chemistry; Life sciences: general issues; Environmental science, engineering & technology

"R for Quantitative Chemistry is an exploration of how the R language can be applied to a wide variety of problems in what is typically termed ""Quantitative Chemistry"" or sometimes ""Analytical Chemistry"". Topics include: basic statistics, spectroscopic data, acid base equilibria and titrations, binding curves (of great current interest for biomedical applications), Fourier Transforms, and chemical kinetics and enzyme kinetics. An innovative feature is the discussion (as an alternative to the less stable nls packages) of the simplex adaptation subplex (R package) coupled with Monte Carlo analysis to determine confidence intervals for estimated parameters resulting from least squares optimization. Chemists who are interested in learning R as a research tool as well as Chemists who are teaching Quantitative Chemistry, as well as their students will be interested. This book is useful as most R books approach data analysis from an economic, social, medical, or biological context. Analysis of chemical data draws upon specific numerical models and a different set R programming and packages than is typically discussed in other disciplines. This book will be based upon, in large part, actual experimental data and will include end of chapter questions and projects. Readers are encouraged to email the author at gosserch@gmail.com and to follow the accompanying blog on Medium ""R Programming for Quantitative Chemistry"".

Key Features:

Elements of R programming for Chemists

Literature Based Examples

Includes Binding Assay Analysis

Integrates theory, experiment, and R programming"

By: David K. Gosser (City College City University of New York)
Imprint: Chapman & Hall/CRC
Country of Publication: United Kingdom
Dimensions: Height: 216mm, Width: 138mm,
Weight: 453g
ISBN: 9781032415475
ISBN 10: 1032415479
Pages: 110
Publication Date: 31 August 2023
Audience: College/higher education , Professional and scholarly , Primary , Undergraduate
Format: Paperback
Publisher's Status: Active

Dr. David Gosser is a Professor of Chemistry at City College of New York, CUNY. Dr. Gosser received his Ph.D. in Physical Inorganic Chemistry from Brown University.