Olivier Taboureau

10PUBLICATIONS
19CO-AUTHORS
Biomolecular modelling and designProcess control and simulationCancer diagnosisEnvironmental biogeochemistryPhysical organic chemistry
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Publications (10)

|Sep 01, 2026
NextTopDocker: A Large-Scale Docking-Power Benchmark Reveals Limitations of Current End-to-End Machine-Learning Docking and the Strength of Hybrid Rescoring.

|Oct 28, 2025
QSAR Models for Predicting Oral Bioavailability and Volume of Distribution and Their Application in Mapping the TK Space of Endocrine Disruptors.

Guillaume Ollitrault, Marco Marzo, Alessandra Roncaglioni

|Aug 04, 2025
Computational prediction of mutagenicity through comprehensive cell painting analysis.

Natacha Cerisier, Emily Truong, Taku Watanabe

|Oct 25, 2024
Computational Tools to Facilitate Early Warning of New Emerging Risk Chemicals.

Farina Tariq, Lutz Ahrens, Nikiforos A Alygizakis

|Aug 28, 2024
Prediction of Endocrine-Disrupting Chemicals Related to Estrogen, Androgen, and Thyroid Hormone (EAT) Modalities Using Transcriptomics Data and Machine Learning.

Guillaume Ollitrault, Marco Marzo, Alessandra Roncaglioni

|Apr 25, 2024
Pred-O3, a web server to predict molecules, olfactory receptors and odor relationships.

Guillaume Ollitrault, Rayane Achebouche, Antoine Dreux

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Frequent Collaborators

2 joint publications

Natacha Cerisier

2 joint publications

Karine Audouze

2 joint publications

Guillaume Ollitrault

2 joint publications

Emilio Benfenati