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Antonio J. Banegas-Luna
Antonio J. Banegas-Luna
Universidad Católica San Antonio de Murcia
Virtual screening
Chemistry
Supercomputer
Computer architecture
Molecular Databases
4
Papers
8
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Towards the Interpretability of Machine Learning Predictions for Medical Applications Targeting Personalised Therapies: A Cancer Case Survey.
2021
International Journal of Molecular Sciences
Antonio J. Banegas-Luna
Jorge Peña-García
Adrian Iftene
Fiorella Guadagni
Patrizia Ferroni
Noemi Scarpato
Fabio Massimo Zanzotto
Andrés Bueno-Crespo
Horacio Pérez-Sánchez
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Is high performance computing a requirement for novel drug discovery and how will this impact academic efforts
2020
Expert Opinion on Drug Discovery
Savíns Puertas-Martín
Antonio J. Banegas-Luna
María Paredes Ramos
Juana López Redondo
Pilar Martínez Ortigosa
Ol’ha O. Brovarets’
Horacio Pérez-Sánchez
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Citations (2)
Labeling IL-18 with alkaloids: toward the use of cytokines as carrier molecules in chemotherapy
2019
Theoretical Chemistry Accounts
Antonio J. Banegas-Luna
Jorge Peña-García
Julia Contreras-García
Horacio Pérez-Sánchez
José P. Cerón-Carrasco
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BRUSELAS: HPC generic and customizable software architecture for 3D ligand-based virtual screening of large molecular databases
2019
Journal of Chemical Information and Modeling
Antonio J. Banegas-Luna
José P. Cerón-Carrasco
Savíns Puertas-Martín
Horacio Pérez-Sánchez
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Citations (5)
1