Josep Arús-Pous

According to our database, Josep Arús-Pous authored at least 9 papers between 2017 and 2023.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2023

Unsupervised Segmentation of Colonoscopy Images.

Heming Yao, Jérôme Lüscher, Benjamín Gutiérrez-Becker, Josep Arús-Pous, Tommaso Biancalani, Amelie Bigorgne, David Richmond

CoRR, 2023

2020

Direct steering of de novo molecular generation with descriptor conditional recurrent neural networks.

Panagiotis-Christos Kotsias, Josep Arús-Pous, Hongming Chen, Ola Engkvist, Christian Tyrchan, Esben Jannik Bjerrum

Nat. Mach. Intell., 2020

REINVENT 2.0: An AI Tool for De Novo Drug Design.

Thomas Blaschke, Josep Arús-Pous, Hongming Chen, Christian Margreitter, Christian Tyrchan, Ola Engkvist, Kostas Papadopoulos, Atanas Patronov

J. Chem. Inf. Model., 2020

SMILES-based deep generative scaffold decorator for de-novo drug design.

Josep Arús-Pous, Atanas Patronov, Esben Jannik Bjerrum, Christian Tyrchan, Jean-Louis Reymond, Hongming Chen, Ola Engkvist

J. Cheminformatics, 2020

2019

A de novo molecular generation method using latent vector based generative adversarial network.

Oleksii Prykhodko, Simon Johansson, Panagiotis-Christos Kotsias, Josep Arús-Pous, Esben Jannik Bjerrum, Ola Engkvist, Hongming Chen

J. Cheminformatics, 2019

Randomized SMILES strings improve the quality of molecular generative models.

Josep Arús-Pous, Simon Johansson, Oleksii Prykhodko, Esben Jannik Bjerrum, Christian Tyrchan, Jean-Louis Reymond, Hongming Chen, Ola Engkvist

J. Cheminformatics, 2019

Exploring the GDB-13 chemical space using deep generative models.

Josep Arús-Pous, Thomas Blaschke, Silas Ulander, Jean-Louis Reymond, Hongming Chen, Ola Engkvist

J. Cheminformatics, 2019

Improving Deep Generative Models with Randomized SMILES.

Josep Arús-Pous, Simon Johansson, Oleksii Prykhodko, Esben Jannik Bjerrum, Christian Tyrchan, Jean-Louis Reymond, Hongming Chen, Ola Engkvist

Proceedings of the Artificial Neural Networks and Machine Learning - ICANN 2019 - 28th International Conference on Artificial Neural Networks, Munich, Germany, September 17-19, 2019, Proceedings, 2019

2017

Virtual Exploration of the Ring Systems Chemical Universe.

Ricardo Visini, Josep Arús-Pous, Mahendra Awale, Jean-Louis Reymond

J. Chem. Inf. Model., November, 2017