Publications by authors named "Benoit Baillif"

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Applying atomistic neural networks to bias conformer ensembles towards bioactive-like conformations.
Benoit Baillif, Jason Cole, Ilenia Giangreco, Patrick McCabe, Andreas Bender

J Cheminform· December 2023

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Deep generative models for 3D molecular structure.
Benoit Baillif, Jason Cole, Patrick McCabe, Andreas Bender

Curr Opin Struct Biol· June 2023

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Exploring the Use of Compound-Induced Transcriptomic Data Generated From Cell Lines to Predict Compound Activity Toward Molecular Targets.
Benoît Baillif, Joerg Wichard, Oscar Méndez-Lucio, David Rouquié

Front Chem· April 2020

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De novo generation of hit-like molecules from gene expression signatures using artificial intelligence.
Oscar Méndez-Lucio, Benoit Baillif, Djork-Arné Clevert, David Rouquié, Joerg Wichard

Nat Commun· January 2020

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