Extensive Attention Mechanisms in Graph Neural Networks for Materials Discovery. - Guojing Cong; Talia Ben-Naim; Victor Fung; Anshul Gupta; Rodrigo Neumann; Mathias Steiner (ICDM (Workshops), 2022)

Prediction of CO2 Adsorption in Nano-Pores with Graph Neural Networks. - Guojing Cong; Anshul Gupta; Rodrigo Neumann; Maíra de Bayser; Mathias Steiner; Breanndán Ó Conchúir (CoRR, 2022)

Automated, LLM enabled extraction of synthesis details for reticular materials from scientific literature. - Viviane Torres da Silva; Alexandre Rademaker; Krystelle Lionti; Ronaldo Giro; Geisa Lima; Sandro Rama Fiorini; Marcelo Archanjo; Breno W. Carvalho; Rodrigo Neumann; Anaximandro Souza; João Pedro Souza; Gabriela de Valnisio; et al. (CoRR, 2024)