Predicting polymerization reactions via transfer learning using chemical language models
- Brenda de Souza Ferrari
- Matteo Manica
- et al.
- 2024
- npj Computational Materials
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Electrofreezing of liquid water at ambient conditions
- Giuseppe Cassone
- Fausto Martelli
- 2024
- Nature Communications
Multi-modal and multi-scale screening of solid sorbent materials for gas capture: The importance of adsorption kinetics
- Rodrigo Neumann Barros Ferreira
- Felipe Lopes de Oliveira
- et al.
- 2023
- ACS Fall 2023
Exploring the impact of molecular force fields on the computational screening of COFs for carbon capture
- Felipe Lopes de Oliveira
- Conor Cleeton
- et al.
- 2023
- ACS Fall 2023
Applying a FAIRness questionnaire to characterize Materials databases
- Leonardo Guerreiro Azevedo
- Julio Cesar Cardoso Tesolin
- et al.
- 2023
- ACS Fall 2023
A Versatile Data Fabric for Advanced IoT-Based Remote Health Monitoring
- Italo Buleje
- Vince Siu
- et al.
- 2023
- ICDH 2023
Information Flow in Graph Neural Networks: A Clinical Triage Use Case
- 2023
- ICDH 2023
A variational condition for minimal-residual latent representations
- 2023
- ICLR 2023
Software Services Engineering Manifesto – A Cross-Cutting Declaration
- Carl K. Chang
- Paolo Ceravolo
- et al.
- 2021
- ICWS 2021
Accelerating computational discovery of porous solids through improved navigation of energy-structure-function maps
- Edward Pyzer-Knapp
- Linjiang Chen
- et al.
- 2021
- Science Advances