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Leonardo Aparecido de Souza
Leonardo Aparecido de Souza
Adjunct Professor and Researcher at Universidade do Estado do Rio de Janeiro
Verified email at uerj.br
Title
Cited by
Cited by
Year
Structural analysis of flavonoids in solution through DFT 1H NMR chemical shift calculations: Epigallocatechin, Kaempferol and Quercetin
LA De Souza, WMG Tavares, APM Lopes, MM Soeiro, WB De Almeida
Chemical Physics Letters 676, 46-52, 2017
692017
DFT study of cisplatin@ carbon nanohorns complexes
LA De Souza, CAS Nogueira, JF Lopes, HF Dos Santos, WB De Almeida
Journal of Inorganic Biochemistry 129, 71-83, 2013
482013
Structural Determination of Antioxidant and Anticancer Flavonoid Rutin in Solution through DFT Calculations of 1H NMR Chemical Shifts
LA De Souza, HC Da Silva, WB De Almeida
ChemistryOpen 7 (11), 902-913, 2018
372018
Theoretical Study of the Formation of Inclusion Complex Between Cisplatin and Single Wall Carbon Nanotube.
LA De Souza, CAS Nogueira, JF Lopes, HF Dos Santos, WB De Almeida
Journal of Physical Chemistry C 119, 8394-8401, 2015
372015
A DFT Study of Molecular Structure and 1H NMR, IR and UV-vis Spectrum of Zn(II)-Kaempferol Complexes: A Metal-flavonoid complex showing enhanced anticancer activity.
LA De Souza, MM Soeiro, WB De Almeida
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY 25773, 1-15, 2018
302018
Inclusion complex between cisplatin and single-walled carbon nanotube: An integrated experimental and theoretical approach
LA De Souza, CAS Nogueira, PFR Ortega, JF Lopes, HDR Calado, ...
Inorganica Chimica Acta 447, 38-44, 2016
302016
Oxidized single-walled carbon nanotubes and nanocones: a DFT study
LA De Souza, AM Da Silva, HF Dos Santos, WB De Almeida
RSC Advances 7 (22), 13212-13222, 2017
282017
A DFT investigation of lithium adsorption on graphenes as a potential anode material in lithium-ion batteries
LA De Souza, G Monteiro de Castro, LF Marques, JC Belchior
Journal of Molecular Graphics and Modelling 108, 107998, 2021
272021
Determination of Anticancer Zn(II)–Rutin Complex Structures in Solution through Density Functional Theory Calculations of 1H NMR and UV–VIS Spectra
HC Da Silva, LA De Souza, HF Dos Santos, WB De Almeida
ACS omega 5 (6), 3030-3042, 2020
272020
Water Solvent Effect on Theoretical Evaluation of 1H NMR Chemical Shifts: o-Methyl-Inositol Isomer
HF Dos Santos, MA Chagas, LA De Souza, WR Rocha, MV De Almeida, ...
The Journal of Physical Chemistry A 121 (14), 2839-2846, 2017
262017
Chemically modified carbon nanohorns as nanovectors of the cisplatin drug: a molecular dynamics study
ER Almeida, LA De Souza, WB De Almeida, HF Dos Santos
Journal of Chemical Information and Modeling 60 (2), 500-512, 2019
232019
Inclusion complexes between cisplatin and oxidized carbon nanostructures: A theoretical approach
LA De Souza, HF Dos Santos, LT Costa, WB De Almeida
Journal of inorganic biochemistry 178, 134-143, 2018
222018
Molecular dynamics of carbon nanohorns and their complexes with cisplatin in aqueous solution
ER Almeida, LA De Souza, WB De Almeida, HF Dos Santos
Journal of Molecular Graphics and Modelling 89, 167-177, 2019
192019
Structure, stability, and infrared spectrum of capped carbon cones: a DFTB study
HF Dos Santos, LA De Souza, WB De Almeida, T Heine
The Journal of Physical Chemistry C 118 (42), 24761-24768, 2014
172014
Theoretical study of structure and non-linear optical properties of Zn (II) porphyrin adsorbed on carbon nanotubes
LA De Souza, AM Da Silva Jr, GMA Junqueira, ACM Carvalho, ...
Journal of Molecular Structure: THEOCHEM 959 (1-3), 92-100, 2010
172010
Exploring the Intense Lanthanide Luminescence and High Thermal Stability in a New Mixed Eu3+/Tb3+ Organic Framework Series for Marking in Gunshot Residues
JP De Oliveira Silva, MV Colaço, LA De Souza, MV Dos Santos, ...
The Journal of Physical Chemistry C 126 (38), 16568-16577, 2022
132022
Synthesis and structural characterization of a 8-hydroxyquinoline derivative coordinated to Zn (II)
LV De Freitas, ALSF Dos Santos, FC Da Costa, JB Calixto, PVP Miranda, ...
Journal of Molecular Structure 1169, 119-129, 2018
122018
Donor–acceptor diethynylsilane oligomers: A second‐order nonlinear optical material
AEDA Machado, LAD Souza, HF Dos Santos, WBD Almeida
Journal of Polymer Science Part B: Polymer Physics 49 (19), 1410-1419, 2011
92011
Chemical Absorption of CO2 Enhanced by Solutions of Alkali Hydroxides and Alkoxides at Room Temperature
PC De Carvalho Pinto, TV Batista, G De Rezende Ferreira, GP Voga, ...
ChemistrySelect 7 (43), e202202731, 2022
72022
Structure and stability of Eu3+ complexes derivatives from non-steroidal anti-inflammatory drug ibuprofen through a DFT study
LA De Souza, LDS Ferreira, EM Gomes, JPO Silva, JC Belchior, ...
Computational and Theoretical Chemistry 1209, 113602, 2022
62022
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Articles 1–20