Peak alignment of NMR signals by means of a genetic algorithm

Genetic algorithms in search, optimization, and machine learning

1989 • 49,726 citations

Adaptation in natural and artificial systems

1975 • 36,178 citations

Genetic Algorithms

2002 • 16,635 citations

Genetic Algorithms in Search

1989 • 10,415 citations

Principal component analysis

1987 • 10,338 citations

Determining optical flow

1981 • 9,272 citations

PLS-regression: a basic tool of chemometrics

2001 • 8,537 citations

'Metabonomics': understanding the metabolic responses of living systems to pathophysiological stimuli via multivariate statistical analysis of biological NMR spectroscopic data

1999 • 3,649 citations

Aligning of single and multiple wavelength chromatographic profiles for chemometric data analysis using correlation optimised warping

1998 • 742 citations

High resolution proton magnetic resonance spectroscopy of biological fluids

1989 • 615 citations

Neural Networks for Chemists: An Introduction

1993 • 563 citations

Neural Networks in Chemistry

1993 • 482 citations

Synchronization of batch trajectories using dynamic time warping

1998 • 447 citations

Introduction to Mathematical Programming

1995 • 238 citations

A comparison of two algorithms for warping of analytical signals

2002 • 214 citations

“Determining optical flow”: a retrospective

1993 • 164 citations

The identification of novel biomarkers of renal toxicity using automatic data reduction techniques and PCA of proton NMR spectra of urine

1998 • 164 citations

Standardization of Second-Order Chromatographic/Spectroscopic Data for Optimum Chemical Analysis

1998 • 134 citations

Automatic reduction of NMR spectroscopic data for statistical and pattern recognition classification of samples

1994 • 108 citations

Application of orthogonal signal correction to minimise the effects of physical and biological variation in high resolution 1H NMR spectra of biofluids

2002 • 98 citations

Evolutionary optimisation: a tutorial

1998 • 93 citations

Partial linear fit: A new NMR spectroscopy preprocessing tool for pattern recognition applications

1996 • 92 citations

NMR of biofluids and pattern recognition: assessing the impact of NMR parameters on the principal component analysis of urine from rat and mouse

2001 • 82 citations

NMR Spectral Quantitation by Principal-Component Analysis. II.Determination of Frequency and Phase Shifts

1996 • 76 citations

Time-warping algorithm applied to chromatographic peak matching gas chromatography/Fourier transform infrared/mass spectrometry

1987 • 76 citations

Automatic Correction for Phase Shifts, Frequency Shifts, and Lineshape Distortions across a Series of Single Resonance Lines in Large Spectral Data Sets

2000 • 64 citations

NMR and Bayesian regularized neural network regression for impurity determination of 4-aminophenol

2002 • 60 citations

A new method for classification of wines based on proton and carbon-13 NMR spectroscopy in combination with pattern recognition techniques

1993 • 50 citations

Automatic correction of peak shifts in Raman spectra before PLS regression

2000 • 47 citations

Full Second-Order Chromatographic/Spectrometric Data Matrices for Automated Sample Identification and Component Analysis by Non-Data-Reducing Image Analysis

1998 • 40 citations

Prediction of physical properties of hydrocarbon mixtures by partial-least-squares calibration of carbon-13 nuclear magnetic resonance data

1989 • 33 citations

Shift and intensity modeling in spectroscopy—general concept and applications

1999 • 30 citations

Mathematical Alignment of Wavelength-Shifted Optical Spectra for Qualitative and Quantitative Analysis

1996 • 25 citations

Deleted Work

1955 • 0 citations