Biostatistics

Metabolic network discovery through reverse engineering of metabolome data

Type of publication: 
Matching Publication
Authors: 
T. Cakir, M.M.W.B. Hendriks, J.A. Westerhuis, A.K. Smilde
Published in: 
Metabolomics
Date of publication: 
2009/09
Status of the publication: 
Published/accepted

Reverse engineering of high-throughput omics data to infer underlying biological networks is one of the challenges in systems biology. However, applications in the field of metabolomics are rather limited. We have focused on a systematic analysis of metabolic network inference from in silico metabolome data based on statistical similarity measures.

Pages: 
2009; 5 (3): 318–329
DOI: 
10.1007/s11306-009-0156-4
Publication data (text): 
2009

PARAFASCA: ASCA combined with PARAFAC for the analysis of metabolic fingerprinting data

Type of publication: 
Matching Publication
Authors: 
J.J. Jansen, R. Bro, H.C.J. Hoefsloot, F.W.J. van den Berg, J.A. Westerhuis, A.K. Smilde
Published in: 
Journal of Chemometrics
Date of publication: 
2008/01
Status of the publication: 
Published/accepted

Novel post-genomics experiments such as metabolomics provide datasets that are highly multivariate and often reflect an underlying experimental design, developed with a specific experimental question in mind. ANOVA-simultaneous component analysis (ASCA) can be used for the analysis of multivariate data obtained from an experimental design instead of the widely used principal component analysis (PCA). This increases the interpretability of the model in terms of the experimental question.

Pages: 
2008; 22 (2): 114-121
DOI: 
10.1002/cem.1105
Publication data (text): 
2008

Crossfit analysis: a novel method to characterize the dynamics of induced plant responses

Type of publication: 
NMC Publication
Authors: 
J.J. Jansen, N.M. van Dam, H.C.J. Hoefsloot, A.K. Smilde
Published in: 
BMC Bioinformatics
Date of publication: 
2009/12
Status of the publication: 
Published/accepted

BACKGROUND

Pages: 
2009; 10: 425
DOI: 
10.1186/1471-2105-10-425
Publication data (text): 
2009

The photographer and the greenhouse: how to analyze plant metabolomics data

Type of publication: 
NMC Publication
Authors: 
J.J. Jansen, S. Smit, H.C.J. Hoefsloot, A.K. Smilde
Published in: 
Phytochemical Analysis
Date of publication: 
2010/01
Status of the publication: 
Published/accepted

INTRODUCTION:

Plant metabolomics experiments yield large amounts of data, too much to be interpretable by eye. Multivariate data analyses are therefore essential to extract and visualise the information of interest.

 

OBJECTIVE:

Because multivariate statistical methods may be remote from the expertise of many scientists working in the metabolomics field, this overview provides a step-by-step description of a multivariate data analysis, starting from the experiment and ending with the figures appearing in scientific journals.

 

Pages: 
2010; 21 (1): 48-60
DOI: 
10.1002/pca.1181
Publication data (text): 
2010

Endocrine pulse identification using penalized methods and a minimum set of assumptions

Type of publication: 
NMC Publication
Authors: 
D.J. Vis, J.A. Westerhuis, H.C.J. Hoefsloot, H. Pijl, F. Roelfsema, J. van der Greef, A.K. Smilde
Published in: 
American Journal of Physiology, Endocrinology and Metabolism
Date of publication: 
2010/02
Status of the publication: 
Published/accepted

The detection of hormone secretion episodes is important for understanding normal and abnormal endocrine functioning, but pulse identification from hormones measured with short interval sampling is challenging. Furthermore, to obtain useable results, the model underlying hormone secretion and clearance must be augmented with restrictions based on biologically acceptable assumptions. Here, using the assumption that there are only a few time points at which a hormone is secreted, we used a modern penalized nonlinear least-squares setup to select the number of secretion events.

Pages: 
2010; 298 (2): E146-155
DOI: 
10.1152/ajpendo.00048.2009
Publication data (text): 
2010

New figures of merit for comprehensive functional genomics data: the metabolomics case

Type of publication: 
NMC Publication
Authors: 
M.F. van Batenburg, L. Coulier, F. van Eeuwijk, A.K. Smilde, J.A. Westerhuis
Published in: 
Analytical Chemistry
Date of publication: 
2011/03
Status of the publication: 
Published/accepted
Pages: 
2011; 83 (9): 3267–3274
DOI: 
10.1021/ac102374c
Publication data (text): 
2011

Reverse engineering of metabolic networks, a critical assessment

Type of publication: 
NMC Publication
Authors: 
D.M. Hendrickx, M.M.W.B. Hendriks, P.H.C. Eilers, A.K. Smilde, H.C.J. Hoefsloot
Published in: 
Molecular Biosystems
Date of publication: 
2011/02
Status of the publication: 
Published/accepted
Pages: 
2011; 7 (2): 511-520
DOI: 
10.1039/C0MB00083C

Improving the analysis of designed studies by combining statistical modelling with study design information

Type of publication: 
Matching Publication
Authors: 
U. Thissen, S. Wopereis, S.A.A. van den Berg, I. Bobeldijk, R. Kleemann, T. Kooistra, K. Willems van Dijk, B. van Ommen, A.K. Smilde
Published in: 
BMC Bioinformatics
Date of publication: 
2009/02
Status of the publication: 
Published/accepted

BACKGROUND:

Pages: 
2009; 10: 52
DOI: 
10.1186/1471-2105-10-52

Biostatistics

Type of theme: 
Core
Short description: 
The aim of the projects within the Bio Statistics theme of the NMC is to develop statistical tools that will serve in creating information from metabolomics data. The products of the projects within the BS theme will be validated methods or algorithms for statistical analysis of metabolomics data. Through delivery of validated and well documented algorithms, the developed methods will be reusable.

The aim of the projects within the Bio Statistics (BS) theme is to develop statistical tools that will serve in creating information from metabolomics data. The products of the projects within the BS theme will be validated methods or algorithms for statistical analysis of metabolomics data. The projects go beyond data analysis based purely on the data by taking the experimental setup and the biological background of the subjects into account. Through delivery of validated and well documented algorithms, the BS projects warrant that the developed methods are reusable.

Theme leader: