Results: 13
Replacing affinity with binding kinetics in QSAR studies resolves otherwise confounded effects.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 370, doi. 10.1002/cem.1010
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- Publication type:
- Article
QSBMR-Quantitative structure biomagnification relationships: physicochemical and structural descriptors important for the biomagnification of organochlorines and brominated flame retardants.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 392, doi. 10.1002/cem.1014
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- Publication type:
- Article
Separating Y-predictive and Y-orthogonal variation in multi-block spectral data.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 352, doi. 10.1002/cem.1007
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- Publication type:
- Article
Investigations of bagged kernel partial least squares (KPLS) and boosting KPLS with applications to near-infrared (NIR) spectra.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 436, doi. 10.1002/cem.1018
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- Publication type:
- Article
Multivariate analysis in reaction mechanism studies.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 386, doi. 10.1002/cem.1013
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- Publication type:
- Article
OPLS discriminant analysis: combining the strengths of PLS-DA and SIMCA classification.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 341, doi. 10.1002/cem.1006
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- Publication type:
- Article
A modification of canonical variates analysis to handle highly collinear multivariate data.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 425, doi. 10.1002/cem.1017
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- Publication type:
- Article
Editorial.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 323, doi. 10.1002/cem.1012
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- Publication type:
- Article
An automated method for peak detection and matching in large gas chromatography-mass spectrometry data sets.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 325, doi. 10.1002/cem.1005
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- Publication type:
- Article
Principal properties (PPs) for lanthanide triflates as Lewis-acid catalysts.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 418, doi. 10.1002/cem.1016
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- Publication type:
- Article
The OPLS methodology for analysis of multi-block batch process data.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 362, doi. 10.1002/cem.1009
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- Publication type:
- Article
Modelling of multi-block data.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 376, doi. 10.1002/cem.1011
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- Publication type:
- Article
Pre-processing in biochemometrics: correction for path-length and temperature effects of water in FTIR bio-spectroscopy by EMSC.
- Published in:
- Journal of Chemometrics, 2006, v. 20, n. 8-10, p. 402, doi. 10.1002/cem.1015
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- Publication type:
- Article