[图书][B] Practical guide to chemometrics

P Gemperline - 2006 - taylorfrancis.com
The limited coverage of data analysis and statistics offered in most undergraduate and
graduate analytical chemistry courses is usually focused on practical aspects of univariate …

[图书][B] Kinetic modeling of reactions in foods

MAJS Van Boekel - 2008 - taylorfrancis.com
The level of quality that food maintains as it travels down the production-to-consumption
path is largely determined by the chemical, biochemical, physical, and microbiological …

Model-based analysis for kinetic and equilibrium investigations

S Norman, M Maeder - Critical Reviews in Analytical Chemistry, 2006 - Taylor & Francis
Equilibrium and kinetic data usually can be described quantitatively by a chemical model
that is based on the law of mass action. In such instances parameters of interest like rate and …

Modeling CO2 Mass Transfer in Amine Mixtures: PZ-AMP and PZ-MDEA

G Puxty, R Rowland - Environmental science & technology, 2011 - ACS Publications
The most common method of carbon dioxide (CO2) capture is the absorption of CO2 into a
falling thin film of an aqueous amine solution. Modeling of mass transfer during CO2 …

Tutorial on the fitting of kinetics models to multivariate spectroscopic measurements with non-linear least-squares regression

G Puxty, M Maeder, K Hungerbühler - Chemometrics and Intelligent …, 2006 - Elsevier
The continuing development of modern instrumentation means an increasing amount of
data is being delivered in less time. As a consequence, it is crucial that research into …

A new multi-wavelength model-based method for determination of enzyme kinetic parameters

MH Sorouraddin, K Amini, A Naseri, J Vallipour… - Journal of …, 2010 - Springer
Lineweaver-Burk plot analysis is the most widely used method to determine enzyme kinetic
parameters. In the spectrophotometric determination of enzyme activity using the …

Uncertainties and error propagation in kinetic hard-modelling of spectroscopic data

J Billeter, YM Neuhold, L Simon, G Puxty… - Chemometrics and …, 2008 - Elsevier
A novel method is presented for the rigorous propagation of uncertainties in initial
concentrations and in dosing rates into the errors in the rate constants fitted by multivariate …

Advances in the modelling and analysis of complex and industrial processes

M Maeder, YM Neuhold, G Puxty… - … and intelligent laboratory …, 2006 - Elsevier
Data fitting is an important tool for the analysis of chemical processes. Limitations in the
traditional fitting programs require strict control of external parameters such as temperature …

Multivariate kinetic hard-modelling of spectroscopic data: A comparison of the esterification of butanol by acetic anhydride on different scales and with different …

G Puxty, YM Neuhold, M Jecklin, M Ehly… - Chemical Engineering …, 2008 - Elsevier
For safety, economic efficiency and environmental efficiency understanding and predicting
the behaviour of a chemical reaction are of greatest importance in industry. Hard-modelling …

Reaction mechanism of transmetalation between tetraorganostannanes and platinum (II) aryltriflate complexes. Mechanistic model for stille couplings

P Nilsson, G Puxty, OF Wendt - Organometallics, 2006 - ACS Publications
The complexes trans-[PtPh (OTf)(PMe2Ph) 2](1) and trans-[PtPh (OTf)(PPh3) 2](4) were
synthesized from the corresponding chloro complexes in moderate yields. Complex 1 is …