Josep Arús-Pous

4PUBLICATIONS
2CO-AUTHORS
Biomolecular modelling and designNeural networksCheminformatics and quantitative structure-activity relationshipsDeep learning
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Publications (4)

|Jan 12, 2021
SMILES-based deep generative scaffold decorator for de-novo drug design.

Josep Arús-Pous, Atanas Patronov, Esben Jannik Bjerrum

|Jan 12, 2021
Randomized SMILES strings improve the quality of molecular generative models.

Josep Arús-Pous, Simon Viet Johansson, Oleksii Prykhodko

|Sep 28, 2020
A Potent and Selective Janus Kinase Inhibitor with a Chiral 3D-Shaped Triquinazine Ring System from Chemical Space.

Kris Meier, Josep Arús-Pous, Jean-Louis Reymond

|Mar 15, 2019
Exploring the GDB-13 chemical space using deep generative models.

Josep Arús-Pous, Thomas Blaschke, Silas Ulander

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Frequent Collaborators

1 joint publications

Kris Meier

1 joint publications

Jean-Louis Reymond