Valerie J Gillet
8PUBLICATIONS
11CO-AUTHORS
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Publications (8)
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|Feb 02, 2026
Explicit Applicability Domain Calculations Can Help Determine When Uncertainty Estimates Are Less Reliable.Zied Hosni, Valerie J Gillet, Richard L Marchese Robinson
|Apr 30, 2024
Interpreting Neural Network Models for Toxicity Prediction by Extracting Learned Chemical Features.Moritz Walter, Samuel J Webb, Valerie J Gillet
|Jan 23, 2024
Synthetically accessible de novo design using reaction vectors: Application to PARP1 inhibitors.Gian Marco Ghiandoni, Stuart R Flanagan, Michael J Bodkin
|Mar 01, 2020
Enhancing reaction-based de novo design using a multi-label reaction class recommender.Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen
|Sep 19, 2019
Development and Application of a Data-Driven Reaction Classification Model: Comparison of an Electronic Lab Notebook and Medicinal Chemistry Literature.Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen
|Jun 11, 2019
Identification of compounds that rescue otic and myelination defects in the zebrafish adgrg6 (gpr126) mutant.Elvira Diamantopoulou, Sarah Baxendale, Antonio de la Vega de León
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Frequent Collaborators
1 joint publications
Elvira Diamantopoulou
1 joint publications
Sarah Baxendale
1 joint publications
Antonio de la Vega de León
1 joint publications
Giselle R Wiggin
1 joint publications
Tanya T Whitfield
1 joint publications
Gian Marco Ghiandoni
1 joint publications
James E A Wallace
1 joint publications
Moritz Walter
1 joint publications
Samuel J Webb
1 joint publications
Zied Hosni
