| Quantum molecular modelling of ibuprofen bound to human serum albumin DS Dantas, JIN Oliveira, JXL Neto, RF da Costa, EM Bezerra, VN Freire, ... RSC Advances 5 (61), 49439-49450, 2015 | 52 | 2015 |
| SARS‐CoV‐2 virus infection: targets and antiviral pharmacological strategies DM de Oliveira Campos, UL Fulco, CBS de Oliveira, JIN Oliveira Journal of evidence-based medicine 13 (4), 255, 2020 | 43 | 2020 |
| Binding energies of the drugs capreomycin and streptomycin in complex with tuberculosis bacterial ribosome subunits JF Vianna, KS Bezerra, JIN Oliveira, EL Albuquerque, UL Fulco Physical Chemistry Chemical Physics 21 (35), 19192-19200, 2019 | 40 | 2019 |
| Quantum biochemistry study of the T3-785 tropocollagen triple-helical structure CRF Rodrigues, JIN Oliveira, UL Fulco, EL Albuquerque, RM Moura, ... Chemical Physics Letters 559, 88-93, 2013 | 35 | 2013 |
| A quantum chemistry investigation of a potential inhibitory drug against the dengue virus GS Ourique, JF Vianna, JXL Neto, JIN Oliveira, PW Mauriz, ... RSC advances 6 (61), 56562-56570, 2016 | 31 | 2016 |
| A quantum biochemistry model of the interaction between the estrogen receptor and the two antagonists used in breast cancer treatment KB Mota, JXL Neto, AHL Costa, JIN Oliveira, KS Bezerra, EL Albuquerque, ... Computational and Theoretical Chemistry 1089, 21-27, 2016 | 30 | 2016 |
| Quantum binding energy features of the T3-785 collagen-like triple-helical peptide KS Bezerra, JIN Oliveira, JXL Neto, EL Albuquerque, EWS Caetano, ... RSC advances 7 (5), 2817-2828, 2017 | 29 | 2017 |
| Fighting covid-19 DMO Campos, CBS Oliveira, JMA Andrade, JIN Oliveira Brazilian Journal of Biology 80 (3), 698-701, 2020 | 27 | 2020 |
| Ribosomal RNA–aminoglycoside hygromycin b interaction energy calculation within a density functional theory framework KS Bezerra, UL Fulco, SC Esmaile, JX Lima Neto, LD Machado, VN Freire, ... The Journal of Physical Chemistry B 123 (30), 6421-6429, 2019 | 26 | 2019 |
| Computational investigation of the α 2 β 1 integrin–collagen triple helix complex interaction KS Bezerra, JXL Neto, JIN Oliveira, EL Albuquerque, EWS Caetano, ... New Journal of Chemistry 42 (20), 17115-17125, 2018 | 23 | 2018 |
| Energetic description of cilengitide bound to integrin JXL Neto, KS Bezerra, DN Manso, KB Mota, JIN Oliveira, EL Albuquerque, ... New Journal of Chemistry 41 (19), 11405-11412, 2017 | 23 | 2017 |
| Intermolecular interactions of cn-716 and acyl-KR-aldehyde dipeptide inhibitors against Zika virus DMO Campos, KS Bezerra, SC Esmaile, UL Fulco, EL Albuquerque, ... Physical Chemistry Chemical Physics 22 (27), 15683-15695, 2020 | 21 | 2020 |
| Exploring the Binding Mechanism of GABAB Receptor Agonists and Antagonists through in Silico Simulations JX Lima Neto, KS Bezerra, ED Barbosa, JIN Oliveira, V Manzoni, ... Journal of chemical information and modeling 60 (2), 1005-1018, 2019 | 21 | 2019 |
| Molecular modelling and quantum biochemistry computations of a naturally occurring bioremediation enzyme: Alkane hydroxylase from Pseudomonas putida P1 BG De Sousa, JIN Oliveira, EL Albuquerque, UL Fulco, VE Amaro, ... Journal of Molecular Graphics and Modelling 77, 232-239, 2017 | 21 | 2017 |
| Exploiting reverse vaccinology approach for the design of a multiepitope subunit vaccine against the major SARS-CoV-2 variants DM de Oliveira Campos, MK da Silva, ED Barbosa, CY Leow, UL Fulco, ... Computational Biology and Chemistry 101, 107754, 2022 | 18 | 2022 |
| Insights into solid-state properties of dopamine and L-Dopa hydrochloride crystals through DFT calculations RL Araújo, JXL Neto, JM Henriques, RM Tromer, CA Barboza, ... Chemical Physics Letters 761, 138033, 2020 | 15 | 2020 |
| Supramolecular aggregates of oligosaccharides with co-solvents in ternary systems for the solubilizing approach of triamcinolone ASA de Medeiros, A Zoppi, EG Barbosa, JIN Oliveira, ... Carbohydrate polymers 151, 1040-1051, 2016 | 15 | 2016 |
| Electronic transport through oligopeptide chains: An artificial prototype of a molecular diode JIN Oliveira, EL Albuquerque, UL Fulco, PW Mauriz, RG Sarmento Chemical Physics Letters 612, 14-19, 2014 | 14 | 2014 |
| Charge transport in fibrous/not fibrous α3-helical and (5Q, 7Q) α3 variant peptides LM Bezerril, UL Fulco, JIN Oliveira, G Corso, EL Albuquerque, VN Freire, ... Applied Physics Letters 98 (5), 2011 | 14 | 2011 |
| Interaction energies between two antiandrogenic and one androgenic agonist receptor in the presence of a T877A mutation in prostate cancer: a quantum chemistry analysis KS Bezerra, JF Vianna, JXL Neto, JIN Oliveira, EL Albuquerque, UL Fulco New Journal of Chemistry 44 (15), 5903-5912, 2020 | 13 | 2020 |