Data sets
- Glucosinolate data
Data set with measurements of 11 glucosinolates in plants at four different times after three different treatments with jasmonic acid.
Reference:
Crossfit analysis: a novel method to characterize the dynamics of induced plant responses
Jeroen Jansen, Nicole M van Dam, Huub CJ Hoefsloot, and Age K. Smilde
BMC Bioinformatics Vol. 10:425 (2009)
- Temperature data set
This data set consists of a set of SW-NIR spectra measured on an HP diode array spectrometer. The data set is used
to trace the influence of the temperature on vibrational spectra and the consequences for the predictive ability of
multivariate calibration models. The data set has been used by several people to test calibration model building.
Reference:
Influence of temperature on vibration
spectra and consequences for multivariate models.
F. Wülfert, W.Th. Kok and A.K. Smilde: Analytical Chemistry, 70(9) (1998), 1761-1767
- Kinetic data set (UV-VIS)
UV-VIS spectra during two-step reaction
Reference:
Determination of rate constants in second-order kinetics using UV-visible spectroscopy
Bijlsma S., Boelens H.F.M and Smilde A.K.: Applied Spectroscopy, 55 (2001), 77-83
- Kinetic data set (SW-NIR)
On-line estimation of reaction constants with SW_NIR
Reference:
Estimating reaction rate constants from a
two-step reaction: a comparison between two-way and three-way methods
Bijlsma S., Smilde A.K.: Journal of chemommetrics, 14 (2000), 541-560
- Gaucher data set
Assessing the statistical validity of proteomics based biomarkers
Reference:
Assessing the statistical validity of proteomics based
biomarkers
Suzanne Smit, Mariëlle J. van Breemen, Huub C.J. Hoefsloot, Age K. Smilde, Johannes M.F.G. Aerts and Chris G.
de Koster: Analytica Chimica Acta, 592 (2) (2007), 210-217
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