Breaking with trends in pre-processing? J Engel, J Gerretzen, E Szymańska, JJ Jansen, G Downey, L Blanchet, ... TrAC Trends in Analytical Chemistry 50, 96-106, 2013 | 561 | 2013 |
Convolutional neural networks for vibrational spectroscopic data analysis J Acquarelli, T van Laarhoven, J Gerretzen, TN Tran, LMC Buydens, ... Analytica chimica acta 954, 22-31, 2017 | 398 | 2017 |
Simple and effective way for data preprocessing selection based on design of experiments J Gerretzen, E Szymańska, JJ Jansen, J Bart, HJ van Manen, ... Analytical chemistry 87 (24), 12096-12103, 2015 | 183 | 2015 |
Chemometrics and qualitative analysis have a vibrant relationship E Szymańska, J Gerretzen, J Engel, B Geurts, L Blanchet, LMC Buydens TrAC Trends in Analytical Chemistry 69, 34-51, 2015 | 131 | 2015 |
Warping methods for spectroscopic and chromatographic signal alignment: a tutorial TG Bloemberg, J Gerretzen, A Lunshof, R Wehrens, LMC Buydens Analytica chimica acta 781, 14-32, 2013 | 108 | 2013 |
Improved parametric time warping for proteomics TG Bloemberg, J Gerretzen, HJP Wouters, J Gloerich, M van Dael, ... Chemometrics and Intelligent Laboratory Systems 104 (1), 65-74, 2010 | 108 | 2010 |
Boosting model performance and interpretation by entangling preprocessing selection and variable selection J Gerretzen, E Szymańska, J Bart, AN Davies, HJ van Manen, ... Analytica Chimica Acta 938, 44-52, 2016 | 60 | 2016 |
The white of the 20th century: an explorative survey into Dutch modern art collections BA Van Driel, KJ van Den Berg, J Gerretzen, J Dik Heritage Science 6, 1-15, 2018 | 30 | 2018 |
Szyma nska J Engel, J Gerretzen E, 2013 | 30 | 2013 |
Understanding Chemical Production Processes by using PLS Path Model Parameters as Soft Sensors. GH van Kollenburg, J van Es, J Gerretzen, H Lanters, R Bouman, ... Computers & Chemical Engineering, 106841, 2020 | 23 | 2020 |
A multivariate approach to investigate the NMR CPMG pulse sequence for analysing low MW species in polymers F Aiello, J Gerretzen, MG Simons, AN Davies, P Dani Magnetic Resonance in Chemistry 59 (2), 172-186, 2021 | 18 | 2021 |
Low-cost handheld NIR spectroscopy for identification of organic solvents and low-level quantification of water contamination GH van Kollenburg, HJ van Manen, N Admiraal, J Gerretzen, JJ Jansen Talanta 223, 121865, 2021 | 17 | 2021 |
Weight randomization test for the selection of the number of components in PLS models T Tran, E Szymańska, J Gerretzen, L Buydens, NL Afanador, L Blanchet Journal of Chemometrics 31 (5), e2887, 2017 | 17 | 2017 |
Process PLS: Incorporating substantive knowledge into the predictive modelling of multiblock, multistep, multidimensional and multicollinear process data G van Kollenburg, R Bouman, T Offermans, J Gerretzen, L Buydens, ... Computers & Chemical Engineering 154, 107466, 2021 | 16 | 2021 |
A novel approach for analyzing gas chromatography-mass spectrometry/olfactometry data J Gerretzen, LMC Buydens, AO Tromp–van den Beukel, E Koussissi, ... Chemometrics and Intelligent Laboratory Systems 146, 290-296, 2015 | 13 | 2015 |
Quantitative vibrational spectroscopy on liquid mixtures: concentration units matter HJ van Manen, J Gerretzen, M Smout, G Postma, JJ Jansen Analyst 146 (10), 3150-3156, 2021 | 6 | 2021 |
Methodology to Predict Thermodynamic Data from Spectroscopic Analysis AJB Ten Kate, J Gerretzen, HJ Van Manen, GM Kontogeorgis, ... Industrial & Engineering Chemistry Research 59 (49), 21548-21566, 2020 | 6 | 2020 |
Optimization of continuous-flow diphenyldiazomethane synthesis: an integrated undergraduate chemistry experiment LTCG van Summeren, J Gerretzen, FPJT Rutjes, TG Bloemberg Journal of Flow Chemistry 11 (1), 59-66, 2021 | 4 | 2021 |
Pre-processing spectroscopic data: for good or ill? AN Davies, J Gerretzen, HJ van Manen Spectroscopy Europe 2020, 2019 | 2 | 2019 |
Package ‘ptw’ J Gerretzen, P Eilers, MT Bloemberg | 1 | 2015 |