Search Results - "Sallum, Lóide"

Exploring the aqueous solubility and intermolecular interactions of diclofenac Diethylammonium: A molecular modeling study in solid state and solvation processes by C. C. Rodrigues, Allane, Sallum, Lóide O., S. N. Aguiar, Antônio, Camargo, Ademir.J., C. B. Oliveira, Heibbe, Napolitano, Hamilton B.

“…•Aqueous solvation significantly influences the geometric and electronic parameters of diclofenac.•The diclofenac exhibits selective intermolecular hydrogen…”
Get full text

Molecular modeling and solubility of olopatadine hydrochloride polymorphs by Santos, Juliane R., Sallum, Lóide O., Silva, Marianna C., Aguiar, Antônio S.N., Martins, José L.R., Perjesi, Pal, Camargo, Ademir J., Napolitano, Hamilton B.

“…[Display omitted] •The olopatadine hydrochloride polymorphs were evaluated using the HS and QTAIM.•Physical chemistry properties were investigated using…”
Get full text

Comparative structural analysis of anhydrous and monohydrated polymorphs of diclofenac diethylammonium: Implications for stability, dissolution, and bioavailability by Sallum, Lóide O., Siqueira, Waléria N., Aguiar, Antônio S.N., Duarte, Vitor S., Sales, Samuel B.S., Lobo, Géssika, Hernandes, Marcelo Z., Camargo, Ademir. J., Napolitano, Hamilton B.

“…[Display omitted] •The supramolecular arrangement was studied using Hirshfeld surface analysis.•Physical chemistry properties were investigated using…”
Get full text

The Influence of Methoxy and Ethoxy Groups on Supramolecular Arrangement of Two Methoxy-chalcones by Custodio, Jean, Faria, Eduardo, Sallum, Lóide, Duarte, Vitor, Vaz, Wesley, de Aquino, Gilberto, Carvalho Jr, Paulo, Napolitano, Hamilton

“…The structures of two methoxylated chalcones, namely (E)-1-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one and…”
Get full text

Aqueous solvation study of melatonin using ab initio molecular dynamics by Rodrigues, Allane C.C., de M. Camargo, Lilian T.F., Francisco Lopes, Yago, Sallum, Lóide O., Napolitano, Hamilton B., Camargo, Ademir J.

“…Snapshot taken from the simulation trajectory showing the hydrogen bonds between melatonin and water molecules. [Display omitted] •Aqueous solvation affects…”
Get full text

Photocatalytic Degradation of Ciprofloxacin: A Combined Experimental and Theoretical Study Using Curcumin and Hydrogen Peroxide by de Paiva, Flórida L. P, Silva, Maria Vivian C, Mendonça, Ana Lara F, Araújo, Cristiane S, Sallum, Lóide O, de Aguiar, Antonio S. N, Lima, Alessandra R, Napolitano, Hamilton B, Calvete, Mário J. F, Dias, Lucas D

“…Contamination of soil, water, and wastewater by pharmaceuticals, including antibiotics, is a global health problem. This work evaluated the use of a natural…”
Get full text

Synthesis, characterization, and supramolecular analysis of a novel chalcone derivative: exploring nonlinear optical applications by Costa, Luiz B., Santos, Cristiane A. F. E., Queiroz, Jaqueline E., Aguiar, Antônio S. N., Sallum, Lóide O., Custodio, Jean M. F., Aquino, Gilberto L. B., Camargo, Ademir J., Valverde, Clodoaldo, Napolitano, Hamilton B.

“…Chalcones have gained attention due to their wide range of biological activities, including anticancer , antimalarial , antimicrobial , antitubercular ,…”
Get full text

Molecular Modeling Studies of β-Sitosterol Extract from Miconia burchellii Triana (Melastomataceae) from Brazilian Cerrado by Silva, Marianna, Duarte, Vitor, Sallum, Lóide, Cunha, Gracielle, Custodio, Jean, Oliver, Allen, Peixoto, Josana, Menezes, Antônio, Napolitano, Hamilton

“…The Brazilian Cerrado biome is considered one of the 25 hotspots worldwide that contain bioactive compounds due to its great biodiversity; however, the…”
Get full text

Effect of the Methanol Molecule on the Stabilization of C18H18O4 Crystal: Combined Theoretical and Structural Investigation by Sallum, Lóide O, Napolitano, Hamilton B, Carvalho, Paulo de Sousa, Cidade, Amanda Feitosa, de Aquino, Gilberto Lucio Benedito, Coutinho, Nayara D, Camargo, Ademir J, Ellena, Javier, de Oliveira, Heibbe C. B, Silva, Valter H. C

“…The ability of the chalcone, C18H18O4, to form solvates was theoretically and experimentally investigated. The unit cell with Z′ > 1, composed of two…”
Get full text

Synthesis, conformational analysis and molecular docking studies on three novel dihydropyrimidine derivatives by Sallum, Lóide O., Vaz, Wesley F., Borges, Nádia M., de Campos, Carlos E.M., Bortoluzzi, Adailton J., Franco, Chris H.J., Ramos, Luciana M., Napolitano, Hamilton B.

“…The dihydropyrimidine (DHPM) derivatives I, II and III were synthesized through Biginelli reaction and characterized by X-ray diffraction and vibrational…”
Get full text

Cyclohexanone-Based Chalcones as Alternatives for Fuel Additives by Sallum, Lóide O, Duarte, Vitor S, Custodio, Jean M. F, Faria, Eduardo C. M, da Silva, Aline M, Lima, Rosa S, Camargo, Ademir J, Napolitano, Hamilton B

“…The use of small molecules, such as chalcones and their derivatives, for more efficient fuels is in increasing demand due to environmental factors. Here, three…”
Get full text

A Comprehensive Topological Analysis of a Novel Flavonoid Extracted from Brazilian Cerrado Plants by Silva, Marianna C., Sallum, Lóide O., Menezes, Antônio C. S., Camargo, Ademir J., Napolitano, Hamilton B.

“…Epicatechin is a bioactive compound that has several biological functions, and can be found in a number of Brazilian Cerrado plants. The compound…”
Get full text

Overview of the Justicia Genus: Insights into Its Chemical Diversity and Biological Potential by Carneiro, Marcos Rodrigo Beltrão, Sallum, Lóide Oliveira, Martins, José Luís Rodrigues, Peixoto, Josana de Castro, Napolitano, Hamilton Barbosa, Rosseto, Lucimar Pinheiro

“…The genus has more than 600 species distributed in both hemispheres, in the tropics and temperate regions, and it is used in the treatment of numerous…”
Get full text

Structural and Anticancer Studies of Methoxyflavone Derivative from Strychnos pseudoquina A.St.-Hil. (Loganiaceae) from Brazilian Cerrado by Silva, Marianna C., Cunha, Gracielle, Firmino, Pollyana, Sallum, Loide O., Menezes, Antônio, Dutra, Jocely, de Araujo-Neto, João, Batista, Alzir A., Ellena, Javier, Napolitano, Hamilton B.

“…The Cerrado biome is the world’s largest and most diversified tropical savanna. Despite its diversity, there remains a paucity of scientific discussion and…”
Get full text

A new isostructural halogenated chalcone with optical properties by Ludovico, Gabriela S., Barros, Itallo H. S., Sallum, Loide O., Lima, Rosa S., Valverde, Clodoaldo, Camargo, Ademir J., Baseia, Basílio, Napolitano, Hamilton B.

“…Chalcones are organic compounds that present a number of properties. This study presents a comprehensive structural description of a new derivative of a…”
Get full text

Overview of the IJusticia/I Genus: Insights into Its Chemical Diversity and Biological Potential by Carneiro, Marcos Rodrigo Beltrão, Sallum, Lóide Oliveira, Ma, Peixoto, Josana de Castro, Napolitano, Hamilton Barbosa, Rosseto, Lucimar Pinheiro

“…The genus Justicia has more than 600 species distributed in both hemispheres, in the tropics and temperate regions, and it is used in the treatment of numerous…”
Get full text

The Effect of the Methanol Molecule in the Stabilization of C 18 H 18 O 4 Chalcone by Napolitano, Hamilton, Sallum, Lóide, Carvalho-Jr, Paulo, Silva, Valter Henrique, Aquino, Gilberto, Camargo, Ademir

“…Abstract only The (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-p-tolylprop-2-en-1-one crystallizes in the triclinic centrossymetric P1 ¯ space group as a solvate…”
Get full text

Effect of the Methanol Molecule on the Stabilization of C 18 H 18 O 4 Crystal: Combined Theoretical and Structural Investigation by Sallum, Lóide O., Napolitano, Hamilton B., Carvalho, Paulo de Sousa, Cidade, Amanda Feitosa, de Aquino, Gilberto Lucio Benedito, Coutinho, Nayara D., Camargo, Ademir J., Ellena, Javier, de Oliveira, Heibbe C. B., Silva, Valter H. C.

Get full text

Análise estrutural e teórica de derivados de Chalconas com atividade biológica e propriedades térmicas by Sallum, Lóide Oliveira

“…Este estudo descreve a síntese e a estrutura de (1E,4E)-1-(3-clorofenil)-5-(2,6,6-trimetilciclohex-1-eno)penta-1,4-dien-3-ona (BC I) pela difração de raios X…”
Get full text

Structural insights and supramolecular description of Gliclazide and its Impurity F by Santos, Marden O., Borges, Igor D., Santin, Lauriane G., Oliveira, Solemar S., Rosseto, Lucimar P., Sallum, Loide O., Camargo, Ademir J., Fajemiroye, James O., Perjesi, Pal, Napolitano, Hamilton B.

“…[Display omitted] •Stability of Gliclazide in pharmaceutical formulations.•Hirshfeld surface is applied the study of intermolecular interactions.•The detailed…”
Get full text