| Machine learning techniques and drug design JC Gertrudes, VG Maltarollo, RA Silva, PR Oliveira, KM Honorio, ... Current medicinal chemistry 19 (25), 4289-4297, 2012 | 208 | 2012 |
| Applying machine learning techniques for ADME-Tox prediction: a review VG Maltarollo, JC Gertrudes, PR Oliveira, KM Honorio Expert opinion on drug metabolism & toxicology 11 (2), 259-271, 2015 | 173 | 2015 |
| A unified view of density-based methods for semi-supervised clustering and classification JC Gertrudes, A Zimek, J Sander, RJGB Campello Data Mining and Knowledge Discovery 33 (6), 1894-1952, 2019 | 23 | 2019 |
| Machine learning techniques applied to the drug design and discovery of new antivirals: a brief look over the past decade MSM Serafim, VS dos Santos Júnior, JC Gertrudes, VG Maltarollo, ... Expert Opinion on Drug Discovery, 1-15, 2021 | 19 | 2021 |
| Knowing and combating the enemy: a brief review on SARS-CoV-2 and computational approaches applied to the discovery of drug candidates MSM Serafim, JC Gertrudes, DMA Costa, PR Oliveira, VG Maltarollo, ... Bioscience Reports 41 (3), BSR20202616, 2021 | 19 | 2021 |
| Molecular docking studies and 2D analyses of DPP-4 inhibitors as candidates in the treatment of diabetes SQ Pantaleão, VG Maltarollo, SC Araujo, JC Gertrudes, KM Honorio Molecular BioSystems 11 (11), 3188-3193, 2015 | 17 | 2015 |
| How Good Is ChatGPT For Detecting Hate Speech In Portuguese? AS Oliveira, TC Cecote, PHL Silva, JC Gertrudes, VLS Freitas, EJS Luz Anais do XIV Simpósio Brasileiro de Tecnologia da Informação e da Linguagem …, 2023 | 14 | 2023 |
| Molecular features related to the binding mode of PPAR δ agonists from QSAR and docking analyses TS Garcia, DC Silva, JC Gertrudes, VG Maltarollo, KM Honorio SAR and QSAR in Environmental Research 24 (2), 157-173, 2013 | 13 | 2013 |
| A unified framework of density-based clustering for semi-supervised classification JC Gertrudes, A Zimek, J Sander, RJGB Campello Proceedings of the 30th International Conference on Scientific and …, 2018 | 12 | 2018 |
| Rethinking Default Values: a Low Cost and Efficient Strategy to Define Hyperparameters RG Mantovani, ALD Rossi, E Alcobaça, JC Gertrudes, SB Junior, ... arXiv preprint arXiv:2008.00025, 2020 | 11 | 2020 |
| ALK-5 inhibition: a molecular interpretation of the main physicochemical properties related to bioactive ligands SC Araujo, VG Maltarollo, DC Silva, JC Gertrudes, KM Honorio Journal of the Brazilian Chemical Society 26, 1936-1946, 2015 | 11 | 2015 |
| MASSA Algorithm: automated rational sampling of training and test subsets for QSAR modelling GC Veríssimo, SQ Panteleão, JC Gertrudes, T Kronenberger, KM Honório, ... | 6 | 2022 |
| A Modularity-Based Measure for Cluster Selection from Clustering Hierarchies FAR dos Anjos, JC Gertrudes, J Sander, RJGB Campello Australasian Conference on Data Mining, 253-265, 2018 | 3 | 2018 |
| Chaotic genetic bee colony: combining chaos theory and genetic bee algorithm for feature selection in microarray cancer classification SR Silva, JC Gertrudes Proceedings of the Genetic and Evolutionary Computation Conference Companion …, 2022 | 2 | 2022 |
| GCN-Based Structure-Activity Relationship and DFT Studies of Staphylococcus aureus FabI Inhibitors GC Veríssimo, VS dos Santos Junior, PO Fernandes, S Ishida, R Kojima, ... International Journal of Quantitative Structure-Property Relationships …, 2022 | 2 | 2022 |
| Correction to: A unified view of density-based methods for semi-supervised clustering and classification JC Gertrudes, A Zimek, J Sander, RJGB Campello Data Mining and Knowledge Discovery 34 (6), 1984-1985, 2020 | 1 | 2020 |
| Emprego de técnicas de análise exploratória de dados utilizados em Química Medicinal JC Gertrudes Universidade de São Paulo, 2013 | 1 | 2013 |
| Semi-supervised learning approaches with applications in Medicinal Chemistry JC Gertrudes Universidade de São Paulo, 0 | 1* | |
| Spending pattern visualization using unsupervised machine learning GP Oliveira, JC Gertrudes, RB Oliveira Anais do XXXVIII Simpósio Brasileiro de Bancos de Dados, 167-178, 2023 | | 2023 |
| Reptilerecon: Um Arcabouço para Extração e Análise de Sinais de Lagartos JGF Zenóbio, PHL Silva, EJ da Silva Luz, GJP Moreira, CAB Galdino, ... Anais do XXXVIII Simpósio Brasileiro de Bancos de Dados, 154-166, 2023 | | 2023 |
Vinicius G. MaltarolloDepartamento de Produtos Farmacêuticos, Faculdade de Farmácia, UFMGEmail verificata su ufmg.br