1.1k citations
- Universitat Pompeu FabraES29 papers
- Institució Catalana de Recerca i Estudis AvançatsES18 papers
- Acellera (Spain)ES6 papers
- Universitat Politècnica de CatalunyaES6 papers
- Institut de Biologia EvolutivaES5 papers
- Freie Universität BerlinDE4 papers
- Center for Theoretical Biological PhysicsUS3 papers
- Centre for Genomic RegulationES3 papers
- Consejo Superior de Investigaciones CientíficasES3 papers
- National Research CouncilLK3 papers
- Rice UniversityUS3 papers
- Santa Fe InstituteUS3 papers
35 papers
Characterisation of exposure to non-ionising electromagnetic fields in the Spanish INMA birth cohort: Study protocol
M. Gallastegi, M. Guxens, A. Jimenez-Zabala +15
Analysis of the association between exposure to electromagnetic fields of non-ionising radiation (EMF-NIR) and health in children and adolescents is hindered by the limited availab…
AMARO: All Heavy-Atom Transferable Neural Network Potentials of Protein Thermodynamics
Antonio Mirarchi, Raul P. Pelaez, Guillem Simeon +1
All-atom molecular simulations offer detailed insights into macromolecular phenomena, but their substantial computational cost hinders the exploration of complex biological process…
mdCATH: A Large-Scale MD Dataset for Data-Driven Computational Biophysics
Antonio Mirarchi, Toni Giorgino, Gianni De Fabritiis
Recent advancements in protein structure determination are revolutionizing our understanding of proteins. Still, a significant gap remains in the availability of comprehensive data…
Discovery of a dormant 33 solar-mass black hole in pre-release Gaia astrometry
Gaia Collaboration, P. Panuzzo, T. Mazeh +412
Gravitational waves from black-hole merging events have revealed a population of extra-galactic BHs residing in short-period binaries with masses that are higher than expected base…
TorchMD-Net 2.0: Fast Neural Network Potentials for Molecular Simulations
Raul P. Pelaez, Guillem Simeon, Raimondas Galvelis +6
Achieving a balance between computational speed, prediction accuracy, and universal applicability in molecular simulations has been a persistent challenge. This paper presents subs…
PlayMolecule Viewer: a toolkit for the visualization of molecules and other data
Mariona Torrens-Fontanals, Panagiotis Tourlas, Stefan Doerr +1
PlayMolecule Viewer is a web-based data visualization toolkit designed to streamline the exploration of data resulting from structural bioinformatics or computer-aided drug design…