| A guide to performing systematic literature reviews in bioinformatics DCB Mariano, C Leite, LHS Santos, REO Rocha, RC de Melo-Minardi arXiv preprint arXiv:1707.05813, 2017 | 60 | 2017 |
| Propedia: a database for protein–peptide identification based on a hybrid clustering algorithm PM Martins, LH Santos, D Mariano, FC Queiroz, LL Bastos, IS Gomes, ... BMC bioinformatics 22, 1-20, 2021 | 43 | 2021 |
| Structure-Based Identification of Naphthoquinones and Derivatives as Novel Inhibitors of Main Protease Mpro and Papain-like Protease PLpro of SARS-CoV-2 LH Santos, T Kronenberger, RG Almeida, EB Silva, REO Rocha, ... Journal of Chemical Information and Modeling 62 (24), 6553-6573, 2022 | 35 | 2022 |
| AI is a viable alternative to high throughput screening: a 318-target study Scientific reports 14 (1), 7526, 2024 | 34 | 2024 |
| Molecular dynamics gives new insights into the glucose tolerance and inhibition mechanisms on β-glucosidases LSC Costa, DCB Mariano, REO Rocha, J Kraml, CH Silveira, KR Liedl, ... Molecules 24 (18), 3215, 2019 | 32 | 2019 |
| A higher flexibility at the SARS-CoV-2 main protease active site compared to SARS-CoV and its potentialities for new inhibitor virtual screening targeting multi-conformers REO Rocha, EJF Chaves, PHC Fischer, LSC Costa, IB Grillo, ... Journal of Biomolecular Structure and Dynamics 40 (19), 9214-9234, 2022 | 16 | 2022 |
| Conformational flexibility correlates with glucose tolerance for point mutations in β-glucosidases–a computational study LHF Lima, ML Fernandez-Quintéro, REO Rocha, DCB Mariano, ... Journal of Biomolecular Structure and Dynamics 39 (5), 1621-1634, 2021 | 16 | 2021 |
| Glutantβase: a database for improving the rational design of glucose-tolerant β-glucosidases D Mariano, N Pantuza, LH Santos, REO Rocha, LHF de Lima, L Bleicher, ... BMC Molecular and Cell Biology 21, 1-15, 2020 | 14 | 2020 |
| Design, Synthesis and In Vitro Trypanocidal and Leishmanicidal Activities of 2‐(2‐Arylidene) hydrazono‐4‐oxothiazolidine‐5‐acetic Acid Derivatives M Haroon, T Akhtar, AC da S. Santos, VRA Pereira, LFGR Ferreira, ... ChemistrySelect 4 (45), 13163-13172, 2019 | 11 | 2019 |
| Proteus: An algorithm for proposing stabilizing mutation pairs based on interactions observed in known protein 3D structures JRMS Barroso, D Mariano, SR Dias, REO Rocha, LH Santos, ... BMC bioinformatics 21, 1-21, 2020 | 9 | 2020 |
| Thermostabilizing mechanisms of canonical single amino acid substitutions at a GH1 β‐glucosidase probed by multiple MD and computational approaches REO Rocha, DCB Mariano, TS Almeida, LS CorrêaCosta, PHC Fischer, ... Proteins: Structure, Function, and Bioinformatics 91 (2), 218-236, 2023 | 5 | 2023 |
| An inexpensive and environmentally friendly staining method for semi-permanent slides from plant material probed using anatomical and computational chemistry analyses CJ Silva, LHF Lima, PM Paiva, LM Maia, REO Rocha, PTD Souza, ... Rodriguésia 71, e01662018, 2020 | 5 | 2020 |
| Cooperative hydrogen bonds and mobility of the non-aromatic ring as selectivity determinants for human acetylcholinesterase to similar anti-Alzheimer’s galantaminics: A … REO Rocha, LHF Lima Journal of Biomolecular Structure and Dynamics 37 (7), 1843-1856, 2019 | 5 | 2019 |
| Evaluating Known Zika Virus NS2B-NS3 Protease Inhibitor Scaffolds via In Silico Screening and Biochemical Assays LH Santos, REO Rocha, DL Dias, BMRM Ribeiro, MSM Serafim, ... Pharmaceuticals 16 (9), 1319, 2023 | 4 | 2023 |
| A guide to performing systematic literature reviews in bioinformatics. arXiv 2017 DCB Mariano, C Leite, LHS Santos, REO Rocha, RC de Melo-Minardi arXiv preprint arXiv:1707.05813, 0 | 4 | |
| Aminopyrimidine Derivatives as Multiflavivirus Antiviral Compounds Identified from a Consensus Virtual Screening Approach MSM Serafim, T Kronenberger, REO Rocha, ADRA Rosa, TLG Mello, ... Journal of Chemical Information and Modeling 64 (2), 393-411, 2024 | 3 | 2024 |
| Milk-Way algorithm for ligand-based virtual screening: CDK2 case study CFV Leite, LHS Santos, LF Leijôto, DCB Mariano, REO Rocha, ... Trends in Developmental Biology 13, 2020 | 3 | 2020 |
| Glycosylation and charge distribution orchestrates the conformational ensembles of a biotechnologically promissory phytase in different pHs–a computational study TPP De Souza, LXS Cantão, MQRB Rodrigues, DB Gonçalves, ... Journal of Biomolecular Structure and Dynamics 42 (10), 5030-5041, 2024 | 1 | 2024 |
| Estudos de modelagem molecular dos mecanismos de afinidade relativa para quatro galantamínicos com potencial anti-Alzheimer REO Rocha Universidade Federal de Minas Gerais, 2017 | 1 | 2017 |
| Apicomplexan mitoribosome from highly fragmented rRNAs to a functional machine C Wang, S Kassem, REO Rocha, P Sun, TT Nguyen, J Kloehn, X Liu, ... Nature Communications 15 (1), 10689, 2024 | | 2024 |
