Gabriel A. Pinheiro

According to our database, Gabriel A. Pinheiro authored at least 5 papers between 2020 and 2022.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of five.

2022

SMICLR: Contrastive Learning on Multiple Molecular Representations for Semisupervised and Unsupervised Representation Learning.

Gabriel A. Pinheiro, Juarez L. F. Da Silva, Marcos G. Quiles

J. Chem. Inf. Model., 2022

Screening of the Role of the Chemical Structure in the Electrochemical Stability Window of Ionic Liquids: DFT Calculations Combined with Data Mining.

Alex S. Moraes, Gabriel A. Pinheiro, Tuanan C. Lourenço, Mauro C. Lopes, Marcos G. Quiles, Luis Gustavo Dias, Juarez L. F. Da Silva

J. Chem. Inf. Model., 2022

The impact of low-cost molecular geometry optimization in property prediction via graph neural network.

Gabriel A. Pinheiro, Felipe V. Calderan, Juarez L. F. Da Silva, Marcos G. Quiles

Proceedings of the 21st IEEE International Conference on Machine Learning and Applications, 2022

2021

Systematic Investigation of Error Distribution in Machine Learning Algorithms Applied to the Quantum-Chemistry QM9 Data Set Using the Bias and Variance Decomposition.

Luis Cesar de Azevedo, Gabriel A. Pinheiro, Marcos G. Quiles, Juarez L. F. Da Silva, Ronaldo C. Prati

J. Chem. Inf. Model., 2021

2020

A Graph-Based Clustering Analysis of the QM9 Dataset via SMILES Descriptors.

Gabriel A. Pinheiro, Juarez L. F. Da Silva, Marinalva D. Soares, Marcos G. Quiles

Proceedings of the Computational Science and Its Applications - ICCSA 2020, 2020