This channel covers research and development into all aspects of chemometric and informatic techniques used in chemical data analysis, including quality control and batch monitoring as well as experimental design and signal processing using PCA, MVA, PARAFAC, PLS, and LIMS.
Quality is of extreme importance for labs. However, it is often seen as the responsibility of the quality manager and its importance and impact on your own work is not always well understood. In this webinar, Peter Kootstra will reinforce how quality can improve your performance and your work satisfaction.Read More
Over the course of the last year, the the Journal of Chemometrics has published a series of perspective and review papers as well as a new regular column which includes a review of the origins of chemometrics and a back-to-basics primer.Read More
Two seconds here could save you months in the lab by using Wiley's Compound Search tool. Check the database coverage now... it's free! We understand that you don't have time to wade through thousands of results. Compound Search's sole purpose is to tell you whether a compound appears in a specific database so that you'll know whether that database meets your needs. To speed this up, we provide exact structure matches only. Compound Search enables users to perform...Read More
Aug 18, 2014
An iterative k-t principal component analysis algorithm with nonrigid frame-to-frame motion correction has been proposed for dynamic contrast-enhanced three-dimensional perfusion imaging.
Aug 15, 2014
In metabolomics experiments, spectral fingerprints of metabolites with no known structural identity are detected routinely. Researchers in the UK have now taken a cheminformatics approach to this problem that lets them measure how similar these unknowns are to known natural product molecules so that they can add this factor to a better ranking of the correct structures in the results list for screening and further investigation.
Jul 15, 2014
Multivariate regression analysis has been used to investigate associations between reported food and drink consumption among 656 women in the first trimester of pregnancy and measures of urinary phthalate metabolite concentrations based on data from a multicentre cohort study, The Infant Development and Environment Study (TIDES). The conclusions, as is common with self-reported data, are mixed and new research is suggested.View All Ezines
Data analysis is a vital part of science today, and in assessing quality, multivariate analysis is often necessary in order to avoid loss of essential information.
The emphasis of this book is on understanding the principles and applications behind the main ideas in chemometrics, which can then be applied to a wide variety of problems in chemistry, chemical engineering and allied disciplines.
Jun 3, 2013
Factor analysis is a mathematical tool for examining a wide range of data sets, with applications especially important to the design of experiments (DOE), spectroscopy, chromatography, and chemometrics. In this free chapter from "Factor Analysis in Chemistry" Edmund Malinowski introduces the technique, declaring that "every problem has a solution"!View All Education Articles
High quality, peer-reviewed original research, reviews and short communications in the fundamental and applied aspects of chemometrics ensure that this international journal is the journal of choice for chemists, statisticians and mathematicians working with chemical data.View All Journals
Mar 22, 2013
Ingvar Eidhammer, Harald Barsnes, Geir Egil Eide, Lennart Martens
Jan 28, 2013
Uwe Kruger, Lei Xie
Sep 14, 2012
Aug 1, 2014
Jul 28, 2014
Jul 23, 2014
Jul 13, 2014
Aug 13, 2014
I came across a common typo recently, steriods, and was reminded of some of the typing errors I had seen in papers over the years.
Date: Mar 10, 2014
Eileen Skelly Frame talks with this year's Pittcon Editors' Award Gold winners, Texas Instruments, about their DLP NIR scan technology.