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Support vector machines (SVM) in near infrared (NIR) spectroscopy: Focus on parameters optimization and model interpretation

Chemometrics and intelligent laboratory systems, 2009-03, Vol.96 (1), p.27-33

2009

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The Benzophenone S1(n,π) → T1(n,π) States Intersystem Crossing Reinvestigated by Ultrafast Absorption Spectroscopy and Multivariate Curve Resolution

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2008-01, Vol.112 (2), p.224-231

2008

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Quality Evaluation of Sugar Beet (Beta vulgaris) by Near-Infrared Spectroscopy

Journal of agricultural and food chemistry, 2004-03, Vol.52 (5), p.1055-1061

2004

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Focus on the potential of hybrid hard- and soft-MCR-ALS in time resolved spectroscopy

Journal of chemometrics, 2008-11, Vol.22 (11-12), p.666-673

2008

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Super-resolution and Raman chemical imaging: From multiple low resolution images to a high resolution image

Analytica chimica acta, 2008-01, Vol.607 (2), p.168-175

2008

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Monitoring and Interpretation of Photoinduced Biochemical Processes by Rapid-Scan FTIR Difference Spectroscopy and Hybrid Hard and Soft Modeling

The journal of physical chemistry. B, 2009-04, Vol.113 (17), p.6031-6040

2009

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The secondary structure and architecture of human elastin

European Journal of Biochemistry, 1998-12, Vol.258 (2), p.533-539

1998

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Multivariate curve resolution applied to Fourier transform infrared spectra of macromolecules: structural characterisation of the acid form and the salt form of humic acids in interaction with lead

Analytica chimica acta, 2003-02, Vol.477 (2), p.201-209

2003

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Bovine Elastin and κ-Elastin Secondary Structure Determination by Optical Spectroscopies (∗)

The Journal of biological chemistry, 1995-11, Vol.270 (44), p.26099-26103

1995

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On-Line Monitoring of a Latex Emulsion Polymerization by Fiber-Optic FT-Raman Spectroscopy. Part I: Calibration

Applied spectroscopy, 2000-04, Vol.54 (4), p.528-535

2000

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Multivariate curve resolution of step-scan FTIR spectral data

Vibrational spectroscopy, 2004-06, Vol.35 (1), p.21-26

2004

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The Benzophenone S 1 (n,π) → T 1 (n,π) States Intersystem Crossing Reinvestigated by Ultrafast Absorption Spectroscopy and Multivariate Curve Resolution

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2008-01, Vol.112 (2), p.224-231

2008

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Degree of hydrolysis from mid-infrared spectra

Analytica chimica acta, 2001-11, Vol.446 (1), p.255-266

2001

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Interpretation and improvement of an artificial neural network MIR calibration

Chemometrics and intelligent laboratory systems, 2002-05, Vol.62 (2), p.189-198

2002

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Neural network modelling for very small spectral data sets: reduction of the spectra and hierarchical approach

Chemometrics and intelligent laboratory systems, 2000-12, Vol.54 (2), p.93-106

2000

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On-Line Mid-Infrared Spectroscopic Data and Chemometrics for the Monitoring of an Enzymatic Hydrolysis

Applied spectroscopy, 2001-12, Vol.55 (12), p.1610-1617

2001

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Hydrolysis of haemoglobin surveyed by infrared spectroscopy: I. solvent effect on the secondary structure of haemoglobin

Journal of molecular structure, 1999-03, Vol.478 (1-3), p.185-191

1999

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Hydrolysis of hemoglobin surveyed by infrared spectroscopy : II. Progress predicted by chemometrics

Analytica chimica acta, 1999-09, Vol.396 (2), p.241-251

1999

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Hybrid hard- and soft-modeling applied to difference spectra

Chemometrics and intelligent laboratory systems, 2007-10, Vol.89 (1), p.26-35

2007

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Quantitative analysis of paper coatings using artificial neural networks

Chemometrics and intelligent laboratory systems, 1997-04, Vol.36 (2), p.125-140

1997

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Chemometrics description of measurement error structure: Study of an ultrafast absorption spectroscopy experiment

Analytica chimica acta, 2009-05, Vol.642 (1), p.19-26

2009

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Hierarchical Neural Network Modeling for Infrared Spectra Interpretation of Modified Starches

Journal of Chemical Information and Computer Sciences, 1999-11, Vol.39 (6), p.1027-1036

1999

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Influence of the Oxidation State of Rhodium in Three-Way Catalysts on Their Catalytic Performances: An in situ FTIR and Catalytic Study

Topics in catalysis, 2004-07, Vol.30/31, p.347-352

2004

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Classification of edible fats and oils by principal component analysis of Fourier transform infrared spectra

Food chemistry, 1996-10, Vol.57 (2), p.245-251

1996

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1H, 13C 2D NMR experiments for the identification of an impurity in lauryl lactam from cyclododecane

Magnetic resonance in chemistry, 1989-10, Vol.27 (10), p.995-997

1989

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Support vector machines (SVM) in near infrared (NIR) spectroscopy: Focus on parameters optimization and model interpretation

The Benzophenone S1(n,π) → T1(n,π) States Intersystem Crossing Reinvestigated by Ultrafast Absorption Spectroscopy and Multivariate Curve Resolution

Quality Evaluation of Sugar Beet (Beta vulgaris) by Near-Infrared Spectroscopy

Focus on the potential of hybrid hard- and soft-MCR-ALS in time resolved spectroscopy

Super-resolution and Raman chemical imaging: From multiple low resolution images to a high resolution image

Monitoring and Interpretation of Photoinduced Biochemical Processes by Rapid-Scan FTIR Difference Spectroscopy and Hybrid Hard and Soft Modeling

The secondary structure and architecture of human elastin

Multivariate curve resolution applied to Fourier transform infrared spectra of macromolecules: structural characterisation of the acid form and the salt form of humic acids in interaction with lead

Bovine Elastin and κ-Elastin Secondary Structure Determination by Optical Spectroscopies (∗)

On-Line Monitoring of a Latex Emulsion Polymerization by Fiber-Optic FT-Raman Spectroscopy. Part I: Calibration

Multivariate curve resolution of step-scan FTIR spectral data

The Benzophenone S 1 (n,π) → T 1 (n,π) States Intersystem Crossing Reinvestigated by Ultrafast Absorption Spectroscopy and Multivariate Curve Resolution

Degree of hydrolysis from mid-infrared spectra

Interpretation and improvement of an artificial neural network MIR calibration

Neural network modelling for very small spectral data sets: reduction of the spectra and hierarchical approach

On-Line Mid-Infrared Spectroscopic Data and Chemometrics for the Monitoring of an Enzymatic Hydrolysis

Hydrolysis of haemoglobin surveyed by infrared spectroscopy: I. solvent effect on the secondary structure of haemoglobin

Hydrolysis of hemoglobin surveyed by infrared spectroscopy : II. Progress predicted by chemometrics

Hybrid hard- and soft-modeling applied to difference spectra

Quantitative analysis of paper coatings using artificial neural networks

Chemometrics description of measurement error structure: Study of an ultrafast absorption spectroscopy experiment

Hierarchical Neural Network Modeling for Infrared Spectra Interpretation of Modified Starches

Influence of the Oxidation State of Rhodium in Three-Way Catalysts on Their Catalytic Performances: An in situ FTIR and Catalytic Study

Classification of edible fats and oils by principal component analysis of Fourier transform infrared spectra

1H, 13C 2D NMR experiments for the identification of an impurity in lauryl lactam from cyclododecane

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