Jordi Mestres

12PUBLICATIONS
93CO-AUTHORS
Chemical engineering designCheminformatics and quantitative structure-activity relationshipsPharmaceutical delivery technologiesComputational modelling and simulation in earth sciencesRadiation and matter
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Publications (12)

|Apr 30, 2026
ChemBang: Expanding the Chemical Space Around Small Molecules.

|Apr 16, 2026
SAFR: Enabling Fragment-Based Drug Discovery with a Synthetic Binding Pose Data Set.

|Mar 27, 2025
Refined ADME Profiles for ATC Drug Classes.

Luca Menestrina, Raquel Parrondo-Pizarro, Ismael Gómez

|Mar 19, 2025
Computational drug repurposing: approaches, evaluation of in silico resources and case studies.

Ziaurrehman Tanoli, Adrià Fernández-Torras, Umut Onur Özcan

|Apr 26, 2024
Design, quality and validation of the EU-OPENSCREEN fragment library poised to a high-throughput screening collection.

Xavier Jalencas, Hannes Berg, Ludvik Olai Espeland

|Dec 04, 2023
Evaluation of QSAR models for predicting mutagenicity: outcome of the Second Ames/QSAR international challenge project.

A Furuhama, A Kitazawa, J Yao

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Frequent Collaborators

2 joint publications

Xavier Jalencas

1 joint publications

A Furuhama

1 joint publications

C E Matos Dos Santos

1 joint publications

J Rathman