4 citations · 7 across the 6 of their papers we have counts for
7 papers
Beyond Chemical Language: A Multimodal Approach to Enhance Molecular Property Prediction
Eduardo Soares, Emilio Vital Brazil, Karen Fiorela Aquino Gutierrez +4
We present a novel multimodal language model approach for predicting molecular properties by combining chemical language representation with physicochemical features. Our approach,…
Retrospective End-User Walkthrough: A Method for Assessing How People Combine Multiple AI Models in Decision-Making Systems
Vagner Figueredo de Santana, Larissa Monteiro Da Fonseca Galeno, Emilio Vital Brazil +2
Evaluating human-AI decision-making systems is an emerging challenge as new ways of combining multiple AI models towards a specific goal are proposed every day. As humans interact…
Human-AI Co-Creation Approach to Find Forever Chemicals Replacements
Juliana Jansen Ferreira, Vinícius Segura, Joana G. R. Souza +4
Generative models are a powerful tool in AI for material discovery. We are designing a software framework that supports a human-AI co-creation process to accelerate finding replace…
Position Paper on Dataset Engineering to Accelerate Science
Emilio Vital Brazil, Eduardo Soares, Lucas Villa Real +4
Data is a critical element in any discovery process. In the last decades, we observed exponential growth in the volume of available data and the technology to manipulate it. Howeve…
Knowledge-augmented Risk Assessment (KaRA): a hybrid-intelligence framework for supporting knowledge-intensive risk assessment of prospect candidates
Carlos Raoni Mendes, Emilio Vital Brazil, Vinicius Segura +1
Evaluating the potential of a prospective candidate is a common task in multiple decision-making processes in different industries. We refer to a prospect as something or someone t…
Toward Human-AI Co-creation to Accelerate Material Discovery
Dmitry Zubarev, Carlos Raoni Mendes, Emilio Vital Brazil +5
There is an increasing need in our society to achieve faster advances in Science to tackle urgent problems, such as climate changes, environmental hazards, sustainable energy syste…