G-FLUXO: A Workflow Portal Specialized in Computational BioChemistry. - Eduardo Gutierrez; Alessandro Costantini; Javier López Cacheiro; Aurelio Rodríguez (IWPLS, 2009)

Porting of GROMACS Package into the Grid Environment: Testing of a New Distribution Strategy. - Alessandro Costantini; Eduardo Gutierrez; Javier López Cacheiro; Aurelio Rodríguez; Osvaldo Gervasi; Antonio Laganà (ICCSA (4), 2010)

On the extension of the grid-empowered molecular science simulator: MD and visualisation tools. - Alessandro Costantini; Eduardo Gutierrez; Javier López Cacheiro; Aurelio Rodríguez; Osvaldo Gervasi; Antonio Laganà (Int. J. Web Grid Serv., 2010)

Optimization of sparse matrix-vector multiplication using reordering techniques on GPUs. - Juan Carlos Pichel; Francisco F. Rivera; Marcos Fernández 002; Aurelio Rodríguez (Microprocess. Microsystems, 2012)

Novel parallelization of simulated annealing and Hooke & Jeeves search algorithms for multicore systems with application to complex fisheries stock assessment models. - Sergio Vázquez; María J. Martín; Basilio B. Fraguela; Andrés Gómez 002; Aurelio Rodríguez; Bjarki Þór Elvarsson (J. Comput. Sci., 2016)

On the successful coexistence of oceanographic operational services with other computational workloads. - Carmen Cotelo; María Aránzazu Amo Baladrón; Roland Aznar; Pablo Lorente; Pablo Rey; Aurelio Rodríguez (Int. J. High Perform. Comput. Appl., 2018)

tsscds2018: A code for automated discovery of chemical reaction mechanisms and solving the kinetics. - Aurelio Rodríguez; Roberto Rodríguez-Fernández; Saulo A. Vázquez; George L. Barnes; James J. P. Stewart; Emilio Martínez-Núñez (J. Comput. Chem., 2018)

Spin-Hall Nano-Oscillator Simulations. - Jon Bertram; Asfand Tanwear; Aurelio Rodríguez; Gary Paterson; Stephen McVitie; Hadi Heidari (IEEE SENSORS, 2019)

AutoMeKin2021: An open-source program for automated reaction discovery. - Emilio Martínez-Núñez; George L. Barnes; David R. Glowacki; Sabine Kopec; Daniel Peláez; Aurelio Rodríguez; Roberto Rodríguez-Fernández; Robin J. Shannon; James J. P. Stewart; Pablo G. Tahoces; Saulo A. Vázquez (J. Comput. Chem., 2021)