Rafael E. O. Rocha

Propedia: a database for protein–peptide identification based on a hybrid clustering algorithm

Pedro Martins, Lucianna Helene Santos, Diego Mariano et al. · BMC Bioinformatics · 2021 · 181 citations · Full text

Structure-Based Identification of Naphthoquinones and Derivatives as Novel Inhibitors of Main Protease M ^pro and Papain-like Protease PL ^pro of SARS-CoV-2

Lucianna Helene Santos, Thales Kronenberger, Renata G. Almeida et al. · Journal of Chemical Information and Modeling · 2022 · 40 citations

Molecular Dynamics Gives New Insights into the Glucose Tolerance and Inhibition Mechanisms on β-Glucosidases

Leon S. C. Costa, Diego Mariano, Rafael E. O. Rocha et al. · Molecules · 2019 · 26 citations · Full text

Engineering, Glycobiology, Molecular Biology +18

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

Rafael E. O. Rocha, Elton José Ferreira Chaves, Pedro Fischer et al. · Journal of Biomolecular Structure and Dynamics · 2021 · 24 citations · Full text

Conformational flexibility correlates with glucose tolerance for point mutations in β-glucosidases – a computational study

Leonardo Henrique França de Lima, Monica L. Fernández‐Quintero, Rafael E. O. Rocha et al. · Journal of Biomolecular Structure and Dynamics · 2020 · 20 citations