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João Paulo Almirão de Jesus
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Computational evidence for nitro derivatives of quinoline and quinoline N-oxide as low-cost alternative for the treatment of SARS-CoV-2 infection
LC Assis, AA de Castro, JPA de Jesus, E Nepovimova, K Kuca, ...
Scientific Reports 11 (1), 6397, 2021
182021
Theoretical insights into the effect of halogenated substituent on the electronic structure and spectroscopic properties of the favipiravir tautomeric forms and its …
LC Assis, AA de Castro, JPA de Jesus, EFF da Cunha, E Nepovimova, ...
Rsc Advances 11 (56), 35228-35244, 2021
162021
Review: theoretical and experimental investigation of the intrinsic properties of Zn2GeO4 nanocrystals
J de Jesus, ACL Santos, FM Pinto, CA Taft, FA La Porta
Journal of Materials Science 56 (7), 4552-4568, 2021
142021
Application of heterostructured CdS/ZnS quantum dots as luminescence down-shifting layer in P3HT: PCBM solar cells
RM Aoki, ET dos Santos Torres, JPA de Jesus, SA Lourenço, ...
Journal of Luminescence 237, 118178, 2021
132021
Theoretical investigation on the effects of electric field on the electronic structure and spectroscopic properties of Zn6− xCdxS6 clusters as model systems of semiconductor …
JPA de Jesus, MZ Jimenez, FA La Porta
Computational Materials Science 188, 110147, 2021
72021
Synthesis and characterization of CdS/ZnS heterostructures to improve the optical properties of CdS quantum dots
ET dos Santos Torres, RM Aoki, JPA de Jesus, JL Duarte, SA Lourenço, ...
Journal of Luminescence 257, 119706, 2023
62023
Effect of drug metabolism in the treatment of SARS-CoV-2 from an entirely computational perspective
JPA de Jesus, LC Assis, AA de Castro, EFF da Cunha, E Nepovimova, ...
Scientific Reports 11, 19998, 2021
62021
Prospects of ZnS and ZnO as smart semiconductor materials in light-activated antimicrobial coatings for mitigation of severe acute respiratory syndrome coronavirus-2 infection
VG Benatto, JPA de Jesus, AA de Castro, LC Assis, TC Ramalho, ...
Materials Today Communications 34, 105192, 2023
52023
Avaliação da Estrutura Eletrônica da Fase Monoclinica do Óxido de Nióbio com Base no uso de Diferentes Funcionais de Densidade
KS Ody, JPA Jesus, CE Cava, AR Albuquerque, AS Maia, JR Sambrano, ...
Química Nova 44 (09), 1124-1131, 2021
22021
Elucidating the spectroscopic and physicochemical properties for a pH-dependent glyphosate structure from a computational perspective
JPA de Jesus, FA La Porta
Computational and Theoretical Chemistry 1226, 114209, 2023
2023
Assessment of the electronic structure of the monoclinic phase of niobium oxide based on the use of different density functionals
KS Ody, J De Jesus, CE Cava, AR Albuquerque, AS Maia, JR Sambrano, ...
Quimica Nova, 1124-1131, 2021
2021
Síntese e Caracterização Óptica de Pontos Quânticos de CdS e Heteroestruturas de CdS/ZnS
ET dos Santos Torres, MAT da Silva, JPA de Jesus, RM Aoki, ...
Revista de Ciências Exatas e Tecnologia 15 (15), 74-79, 2020
2020
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Articles 1–12