Chemical reaction network knowledge graphs: the OntoRXN ontology. - Diego Garay-Ruiz; Carles Bo (J. Cheminformatics, 2022)

POMSimulator: An open-source tool for predicting the aqueous speciation and self-assembly mechanisms of polyoxometalates. - Enric Petrus; Jordi Buils; Diego Garay-Ruiz; Mireia Segado-Centellas; Carles Bo (J. Comput. Chem., 2024)