Valerie J Gillet

Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 13

Top Venues

Journal of chemical information and modeling

Molecular informatics

ChemMedChem

eLife

University of Sheffield

This page only lists publications with an associated author ORCID identifier.

Affiliation History

University of Sheffield

United Kingdom

Professor of Chemoinformatics :: Information School

Publications

Gian Marco Ghiandoni, Stuart R Flanagan, Michael J Bodkin, Maria Giulia Nizi, Albert Galera-Prat, Annalaura Brai, Beining Chen, James E A Wallace, Dimitar Hristozov, James Webster, Giuseppe Manfroni, Lari Lehtiö, Oriana Tabarrini, Valerie J Gillet
Synthetically accessible de novo design using reaction vectors: Application to PARP1 inhibitors. Molecular informatics 43 (4) (2024)
Gian Marco Ghiandoni, Stuart R Flanagan, Michael J Bodkin, Maria Giulia Nizi, Albert Galera-Prat, Annalaura Brai, Beining Chen, James E A Wallace, Dimitar Hristozov, James Webster, Giuseppe Manfroni, Lari Lehtiö, Oriana Tabarrini, Valerie J Gillet
Synthetically accessible de novo design using reaction vectors: Application to PARP1 inhibitors. Molecular informatics 43 (4) (2024)
Gian Marco Ghiandoni, Stuart R Flanagan, Michael J Bodkin, Maria Giulia Nizi, Albert Galera-Prat, Annalaura Brai, Beining Chen, James E A Wallace, Dimitar Hristozov, James Webster, Giuseppe Manfroni, Lari Lehtiö, Oriana Tabarrini, Valerie J Gillet
Synthetically accessible de novo design using reaction vectors: Application to PARP1 inhibitors. Molecular informatics 43 (4) (2024)
Moritz Walter, Samuel J Webb, Valerie J Gillet
Interpreting Neural Network Models for Toxicity Prediction by Extracting Learned Chemical Features. Journal of chemical information and modeling 64 (9) (2024)
Moritz Walter, Samuel J Webb, Valerie J Gillet
Interpreting Neural Network Models for Toxicity Prediction by Extracting Learned Chemical Features. Journal of chemical information and modeling 64 (9) (2024)
Moritz Walter, Samuel J Webb, Valerie J Gillet
Interpreting Neural Network Models for Toxicity Prediction by Extracting Learned Chemical Features. Journal of chemical information and modeling 64 (9) (2024)
Moritz Walter, Samuel J Webb, Valerie J Gillet
Interpreting Neural Network Models for Toxicity Prediction by Extracting Learned Chemical Features. Journal of chemical information and modeling (2024)
Gian Marco Ghiandoni, Stuart R Flanagan, Michael J Bodkin, Maria Giulia Nizi, Albert Galera-Prat, Annalaura Brai, Beining Chen, James E A Wallace, Dimitar Hristozov, James Webster, Giuseppe Manfroni, Lari Lehtiö, Oriana Tabarrini, Valerie J Gillet
Synthetically accessible de novo design using reaction vectors: Application to PARP1 inhibitors. Molecular informatics (2024)
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, Dimitar Hristozov, James E A Wallace, James Webster, Valerie J Gillet
Enhancing reaction-based de novo design using a multi-label reaction class recommender. Journal of computer-aided molecular design 34 (7) (2020)
Elvira Diamantopoulou, Sarah Baxendale, Antonio de la Vega de León, Anzar Asad, Celia J Holdsworth, Leila Abbas, Valerie J Gillet, Giselle R Wiggin, Tanya T Whitfield
Identification of compounds that rescue otic and myelination defects in the zebrafish adgrg6 (gpr126) mutant. eLife 8 (2019)
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, Dimitar Hristozov, James E A Wallace, James Webster, Valerie J Gillet
Development and Application of a Data-Driven Reaction Classification Model: Comparison of an Electronic Lab Notebook and Medicinal Chemistry Literature. Journal of chemical information and modeling 59 (10) (2019)
Matthew P Seddon, David A Cosgrove, Valerie J Gillet
Bioisosteric Replacements Extracted from High-Quality Structures in the Protein Databank. ChemMedChem 13 (6) (2018)
Matthew P Seddon, David A Cosgrove, Martin J Packer, Valerie J Gillet
Alignment-Free Molecular Shape Comparison Using Spectral Geometry: The Framework. Journal of chemical information and modeling 59 (1) (2018)

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Publication Activity (10 Years)

Top Topics

Top Venues

Valerie J Gillet