Publicaciones en colaboración con investigadores/as de Universitat Politècnica de Catalunya (41)

2024

  1. A Study on the Robustness and Stability of Explainable Deep Learning in an Imbalanced Setting: The Exploration of the Conformational Space of G Protein-Coupled Receptors

    International Journal of Molecular Sciences, Vol. 25, Núm. 12

  2. Author Correction: GPCR molecular dynamics forecasting using recurrent neural networks (Scientific Reports, (2023), 13, 1, (20995), 10.1038/s41598-023-48346-4)

    Scientific Reports

  3. Exploring Data Distributions in Machine Learning Models with SOMs

    Lecture Notes in Networks and Systems

  4. Understanding predictions of drug profiles using explainable machine learning models

    BioData Mining, Vol. 17, Núm. 1

2023

  1. Advances in Numerical Modeling of Coupled CFD Problems

    Journal of Marine Science and Engineering

  2. GPCR molecular dynamics forecasting using recurrent neural networks

    Scientific Reports, Vol. 13, Núm. 1

  3. Layer-Wise Relevance Analysis for Motif Recognition in the Activation Pathway of the β2-Adrenergic GPCR Receptor

    International Journal of Molecular Sciences, Vol. 24, Núm. 2

  4. Recognition of Conformational States of a G Protein-Coupled Receptor from Molecular Dynamic Simulations Using Sampling Techniques

    Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)

  5. Toppling susceptibility of a single rock block resting on a regularly rough base

    Engineering Geology, Vol. 313

2022

  1. A Deep Learning-Based Method for Uncovering GPCR Ligand-Induced Conformational States Using Interpretability Techniques

    Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)

  2. A Unified Arbitrary Lagrangian–Eulerian Model for Fluid–Structure Interaction Problems Involving Flows in Flexible Channels

    Journal of Scientific Computing, Vol. 90, Núm. 3

  3. An enhanced semi-explicit particle finite element method for incompressible flows

    Computational Mechanics, Vol. 70, Núm. 3, pp. 607-620

  4. I CONGRESO ESPAÑOL DE VIDEOJUEGOS 2022

    CEUR Workshop Proceedings

  5. Life cycle assessment of PE and PP multi film compared with PLA and PLA reinforced with nanoclays film

    Journal of Cleaner Production, Vol. 380

  6. Long Short-Term Memory to Predict 3D Amino Acids Positions in GPCR Molecular Dynamics

    Frontiers in Artificial Intelligence and Applications

  7. Molecular Dynamics forecasting of transmembrane Regions in GPRCs by Recurrent Neural Networks

    BHI-BSN 2022 - IEEE-EMBS International Conference on Biomedical and Health Informatics and IEEE-EMBS International Conference on Wearable and Implantable Body Sensor Networks, Symposium Proceedings

  8. Visual Insights from the Latent Space of Generative Models for Molecular Design

    Lecture Notes in Networks and Systems

2021

  1. Anisotropic deformability and strength of slate from NW-Spain

    International Journal of Rock Mechanics and Mining Sciences, Vol. 148

2020

  1. A Sensor Data-Based Approach for the Definition of Condition Taxonomies for a Hydraulic Pump †

    Engineering Proceedings, Vol. 2, Núm. 1

  2. An explicit/implicit Runge–Kutta-based PFEM model for the simulation of thermally coupled incompressible flows

    Computational Particle Mechanics, Vol. 7, Núm. 1, pp. 57-69