Explanatory Analysis of the Metabolome Using Genetic Programming of Simple, Interpretable Rules. - Helen E. Johnson; Richard J. Gilbert; Michael K. Winson; Royston Goodacre; Aileen R. Smith; Jem J. Rowland; Michael A. Hall; Douglas B. Kell (Genet. Program. Evolvable Mach., 2000)

Genetic algorithm optimization for pre-processing and variable selection of spectroscopic data. - Roger M. Jarvis; Royston Goodacre (Bioinform., 2005)

PYCHEM: a multivariate analysis package for python. - Roger M. Jarvis; David Broadhurst; Helen E. Johnson; Noel M. O'Boyle; Royston Goodacre (Bioinform., 2006)

A genetic algorithm-Bayesian network approach for the analysis of metabolomics and spectroscopic data: application to the rapid detection of Bacillus spores and identification of Bacillus species. - Elon Santos Correa; Royston Goodacre (BMC Bioinform., 2011)

Automated workflows for accurate mass-based putative metabolite identification in LC/MS-derived metabolomic datasets. - Marie Brown; David C. Wedge; Royston Goodacre; Douglas B. Kell; Philip N. Baker; Louise C. Kenny; Mamas A. Mamas; Ludwig Neyses; Warwick B. Dunn (Bioinform., 2012)

A novel untargeted metabolomics correlation-based network analysis incorporating human metabolic reconstructions. - Helen L. Kotze; Emily G. Armitage; Kieran J. Sharkey; James William Allwood; Warwick B. Dunn; Kaye J. Williams; Royston Goodacre (BMC Syst. Biol., 2013)

MUSCLE: automated multi-objective evolutionary optimization of targeted LC-MS/MS analysis. - James Bradbury 001; Grégory Genta-Jouve; James William Allwood; Warwick B. Dunn; Royston Goodacre; Joshua D. Knowles; Shan He 001; Mark R. Viant (Bioinform., 2015)

Improved Descriptors for the Quantitative Structure-Activity Relationship Modeling of Peptides and Proteins. - Mark H. Barley; Nicholas J. Turner; Royston Goodacre (J. Chem. Inf. Model., 2018)

Simultaneous Multiplexed Quantification of Banned Sudan Dyes Using Surface Enhanced Raman Scattering and Chemometrics. - Taghrid S. Alomar; Najla AlMasoud; Yun Xu; Cassio Lima; Baris Akbali; Simon Maher; Royston Goodacre (Sensors, 2022)

Simultaneous Raman and Infrared Spectroscopy of Stable Isotope Labelled Escherichia coli. - Cassio Lima; Howbeer Muhamadali; Royston Goodacre (Sensors, 2022)