Joe Wandy

6PUBLICATIONS
23CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsMetabolomic chemistryMedical biochemistry - inorganic elements and compoundsProteomics and metabolomics
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Publications (6)

|Jul 06, 2026
Large-scale discovery and annotation of substructure patterns in mass spectrometry profiles.

|Jun 26, 2023
TopNEXt: automatic DDA exclusion framework for multi-sample mass spectrometry experiments.

Ross McBride, Joe Wandy, Stefan Weidt

|May 04, 2021
Ranking microbial metabolomic and genomic links in the NPLinker framework using complementary scoring functions.

Grímur Hjörleifsson Eldjárn, Andrew Ramsay, Justin J J van der Hooft

|Mar 06, 2021
Ranking Metabolite Sets by Their Activity Levels.

Karen McLuskey, Joe Wandy, Isabel Vincent

|Jul 19, 2019
MolNetEnhancer: Enhanced Molecular Networks by Integrating Metabolome Mining and Annotation Tools.

Madeleine Ernst, Kyo Bin Kang, Andrés Mauricio Caraballo-Rodríguez

|May 24, 2019
Deciphering complex metabolite mixtures by unsupervised and supervised substructure discovery and semi-automated annotation from MS/MS spectra.

Simon Rogers, Cher Wei Ong, Joe Wandy

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Frequent Collaborators

5 joint publications

Justin J J van der Hooft

4 joint publications

Simon Rogers

3 joint publications

Rónán Daly

2 joint publications

Madeleine Ernst