MOST CITED SCHOLAR PUBLICATIONS
- Bioactive natural compounds and antioxidant activity of essential oils from spice plants: New findings and potential applicationsL Diniz do Nascimento, AAB Moraes, KS Costa, JM Pereira Galcio, ...Biomolecules 10 (7), 988 2020Citations: 295
- Exploring the potentiality of natural products from essential oils as inhibitors of odorant-binding proteins: A structure-and ligand-based virtual screening approach to findKS da Costa, JM Galcio, CHS da Costa, AR Santana, ...ACS omega 4 (27), 22475-22486 2019Citations: 66
- Analysis of Conformational, Structural, Magnetic, and Electronic Properties Related to Antioxidant Activity: Revisiting Flavan, Anthocyanidin, Flavanone, Flavonol, IsoflavoneSA de Souza Farias, KS da Costa, JBL MartinsACS omega 6 (13), 8908-8918 2021Citations: 63
- Predicting cell-penetrating peptides using machine learning algorithms and navigating in their chemical spaceECL de Oliveira, K Santana, L Josino, AH Lima e Lima, ...Scientific reports 11 (1), 7628 2021Citations: 58
- In silico analyses of toxicity of the major constituents of essential oils from two Ipomoea L. speciesOS da Silva Jnior, CJP Franco, AAB de Moraes, JN Cruz, KS da Costa, ...Toxicon 195, 111-118 2021Citations: 55
- Applications of virtual screening in bioprospecting: facts, shifts, and perspectives to explore the chemo-structural diversity of natural productsK Santana, LD Do Nascimento, A Lima e Lima, V Damasceno, C Nahum, ...Frontiers in Chemistry 9, 662688 2021Citations: 50
- Measuring the structural impact of mutations on cytochrome P450 21A2, the major steroid 21-hydroxylase related to congenital adrenal hyperplasiaJN Cruz, KS da Costa, TAA de Carvalho, NAN de AlencarJournal of Biomolecular Structure and Dynamics 2019Citations: 43
- Assessment of the PETase conformational changes induced by poly (ethylene terephthalate) bindingCHS da Costa, AM Dos Santos, CN Alves, S Mart, V Moliner, K Santana, ...Proteins: Structure, Function, and Bioinformatics 89 (10), 1340-1352 2021Citations: 40
- Drying Effects on Chemical Composition and Antioxidant Activity of Lippia thymoides Essential Oil, a Natural Source of ThymolLD Nascimento, SG Silva, MM Cascaes, KS Costa, PLB Figueiredo, ...Molecules 26 (9), 2621 2021Citations: 25
- Structural analysis of viral infectivity factor of HIV type 1 and its interaction with A3G, EloC and EloBKS da Costa, E Leal, AM dos Santos, AH Lima e Lima, CN Alves, ...PLoS One 9 (2), e89116 2014Citations: 25
- First report on the Annona exsucca DC. Essential oil and in silico identification of potential biological targets of its major compoundsMM Cascaes, SG Silva, JN Cruz, M Santana de Oliveira, J Oliveira, ...Natural Product Research 36 (15), 4009-4012 2022Citations: 22
- Targeting shikimate pathway: In silico analysis of phosphoenolpyruvate derivatives as inhibitors of EPSP synthase and DAHP synthaseMD de Oliveira, JO Araujo, JMP Galcio, K Santana, AH LimaJournal of Molecular Graphics and Modelling 101, 107735 2020Citations: 22
- Biological Membrane-Penetrating Peptides: Computational Prediction and ApplicationsECL de Oliveira, KS da Costa, PS Taube, AH LimaFront. Cell. Infect. Microbiol. 12: 838259. doi: 10.3389/fcimb 2022Citations: 19
- In silico identification of natural products with anticancer activity using a chemo-structural database of Brazilian biodiversityJM Galcio, EF Monteiro, DA de Jesus, CH Costa, RC Siqueira, ...Computational biology and chemistry 83, 107102 2019Citations: 18
- Investigation of the target-site resistance of EPSP synthase mutants P106T and T102I/P106S against glyphosateECM Fonseca, KS da Costa, J Lameira, CN Alves, AH LimaRSC advances 10 (72), 44352-44360 2020Citations: 16
- Synthesis, characterization, applications, and toxicity of green synthesized nanoparticlesJMP Galcio, SGB de Souza, AA Vasconcelos, AKO Lima, KS da Costa, ...Current pharmaceutical biotechnology 23 (3), 420-443 2022Citations: 15
- Structural and evolutionary analysis of Leishmania Alba proteinsKS da Costa, JMP Galcio, ES Leonardo, G Cardoso, Leal, G Conde, ...Molecular and biochemical parasitology 217, 23-31 2017Citations: 14
- Analysis of kojic acid derivatives as competitive inhibitors of tyrosinase: a molecular modeling approachR Cardoso, R Valente, CH Souza da Costa, JL da S. Gonalves Vianez Jr, ...Molecules 26 (10), 2875 2021Citations: 13
- Unraveling the conformational dynamics of glycerol 3-phosphate dehydrogenase, a nicotinamide adenine dinucleotide-dependent enzyme of Leishmania mexicanaCHS Costa, TW Bichara, GC Gomes, AM Dos Santos, KS da Costa, ...Journal of Biomolecular Structure and Dynamics 39 (6), 2044-2055 2021Citations: 13
- Multi-scale detection of rate changes in spike trains with weak dependenciesM Messer, KM Costa, J Roeper, G SchneiderJournal of computational neuroscience 42, 187-201 2017Citations: 13
