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12:42, sáb dez 21

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ARTIGOS RECENTES


Artigo

CARACTERIZAÇÕES FÍSICO-QUÍMICAS DAS CERÂMICAS DO SÍTIO ARQUEOLÓGICO ININGA, TERESINA, PIAUÍ

Raimundo O. Lima Júnior; Thamires P. dos Santos Lima; Renato P. de Sousa; Wilkins O. de Barros; Benedito B. Farias Filho;
Aline G. de Freitas; Ângelo Alves Correa; Maria Conceição S. M. Lage

This is a representation of a test well where a ceramic artifact was located and this fragment was characterized by scanning electron microscopy (SEM), Fourier transform infrared spectroscopy (FTIR), X-ray fluorescence spectroscopy (FRX), X-ray diffraction (XRD) and optical microscopy to determine composition characteristics and manufacturing method of the piece.

http://dx.doi.org/10.21577/0100-4042.20250092

Publicado online: dezembro 20, 2024
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Total access: 12

INVESTIGATING CHOLAGOGUE AND CHOLERETIC ACTIVITY OF Peumus boldus

Raphael S. F. Silva; Marcus Vinícius H. Faria; Joyce F. S. D. de Almeida; Tanos C. C. França

Boldine alkaloid bonded to farnesoid X receptor: a possible molecular target of cholagogue and choleretic activity of Peumus Boldus.

http://dx.doi.org/10.21577/0100-4042.20250091

Publicado online: dezembro 20, 2024
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Total access: 13

PREDICCIÓN DE TOXICIDAD ACUÁTICA MEDIANTE QSAR TOOLBOX: UN ENFOQUE IN SILICO PARA LA EVALUACIÓN DE RIESGOS QUÍMICOS EN LA FRACTURACIÓN HIDRÁULICA

Adolfo E. Ensuncho; Diana B. Ramírez; Jesús M. López

In this study, the aquatic toxicity of some chemical compounds present in hydraulic fracturing fluids was estimated through quantitative modeling of structure-activity relationships for the evaluation of risk potential in inland water fish: Pimephales promelas, Oreochromis niloticus and Oncorhynchus mykiss.

http://dx.doi.org/10.21577/0100-4042.20250090

Publicado online: dezembro 20, 2024
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Total access: 20

A GREEN AND EFFICIENT HPLC-DAD METHOD FOR THE ANALYSIS OF PHENOLIC COMPOUNDS IN ORANGE WASTE

Mirella T. Ferreira Ranzeti; Gabriela Cremasco; Daniel Rinaldo

The orange peel was treated and used for extraction by dynamic maceration with a 7:3 (v/v) EtOH/H2O solution, where a green chromatographic method was developed using bioethanol and water to identify compounds such as hesperidin.

http://dx.doi.org/10.21577/0100-4042.20250089

Publicado online: dezembro 20, 2024
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Total access: 19

ELECTROCHEMICAL CORROSION EVALUATION OF SnSb ELECTRODEPOSITED COATINGS

Ana Aline C. Alcanfor; Natalia G. Sousa; Othon S. Campos; Alan S. de Menezes; Edipo S. de Oliveira; Hamilton F. G. de Abreu;
Paulo N. S. Casciano; Pedro de Lima Neto; Adriana N. Correia

The graph summarizes the change in the morphology of the electrodeposited coatings as a function of the percentage of Sb. The corrosion tests complement this effect in a neutral medium.

http://dx.doi.org/10.21577/0100-4042.20250086

Publicado online: dezembro 10, 2024
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Total access: 39

ANALYSIS OF THERMAL DECOMPOSITION KINETICS AND THERMAL HAZARD ASSESSMENT OF NITROBENZOIC ACID ISOMERS BY DSC AND THERMOGRAVIMETRIC METHOD

Xin Yi Lia, Zhi Xiang Xing; Ye Cheng Liu; Yang Cheng; An Chi Huang

The thermal decomposition of nitro compounds was analyzed by differential thermal method and thermogravimetric method, the apparent activation energy was calculated and the reaction type was verified, the molecular structure was optimized by quantum chemistry method, and the Mayer bond sequence was calculated to verify the thermogravimetric experiment results.

http://dx.doi.org/10.21577/0100-4042.20250084

Publicado online: dezembro 6, 2024
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Total access: 49

Systematic design of high-performance CO gas sensor based on QCM and the impact of environmental humidity

Luyu WangI,*; Chenghai RuanII; Chunyang YuII; Jia SongIII,*

Based on the quartz crystal microbalance (QCM) platform and utilizing CeO2 nanorods as the sensitive material, a superior carbon monoxide sensor has been systematically developed for the first time.

http://dx.doi.org/10.21577/0100-4042.20250083

Publicado online: dezembro 4, 2024
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Total access: 52

Importância dos ensaios físico-químicos no controle de qualidade de vacinas

Maria P. Blanco; Cristiane Barata Silva; Santos A. Vicentini Neto; Lara M. Catarino; Ozeias de Lima Leitão; Elizabete P. Figuerêdo; Mateus H. M. Neves; Silvana C. Jacob; Lisia M. G. dos Santos*

Established in 1973, Brazil's National Immunization Program (NIP) is one of the largest in the world. It conducts physicochemical assays, continually improving techniques to ensure vaccine safety and efficacy.

http://dx.doi.org/10.21577/0100-4042.20250082

Publicado online: dezembro 2, 2024
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Total access: 72

Avaliação e comparação dos sistemas coloidais de leites uht comercializados nas regiões sul e sudeste do Brasil

Gabriel de A. FarageI,*; Ítalo T. PerroneI; Rodrigo StephaniII,*; Nathalia da S. CamposII; Natália M. G. AlvesII

Ultra high temperature (UHT) processing promotes a series of heat-induced changes that can lead to colloidal destabilization of milk. Through physical-chemical analyses it is possible to evaluate and compare the colloidal systems of commercial UHT milk samples.

http://dx.doi.org/10.21577/0100-4042.20250081

Publicado online: novembro 28, 2024
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Total access: 63

TERPENES OF Melipona quadrifasciata GEOPROPOLIS

Marta S. D. Freitas; Matheus H. O. de Sousa; Alexandre Piccinini; Luiz Antonio Mendonça Alves da Costa; Neusa F. de Moura

Analysis of mono and sesquiterpenes from geopropolis powder by headspace-gas chromatography/mass spectrometry (HS-GC/MS) and analysis of di and triterpenes by GC-MS after ultrasound extraction.

http://dx.doi.org/10.21577/0100-4042.20250080

Publicado online: novembro 28, 2024
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Total access: 83

Chemotype verboccidentafuran in Baccharis punctulata (Asteraceae): furanic sesquiterpenes correlation and molecular docking into the benzodiazepine receptor

Jociani AscariI,*; Murilo S. de OliveiraI; André L. RüdigerI; Elaine ElisabetskyII; Domingos S. NunesIII; Jorge IulekIII;
Dilamara R. ScharfIV; Gustavo HeidenV

Considering the occurrence and availability of verboccidentafuran in the species Baccharis punctulata DC. and its structural similarity to curzerene, docking calculations were performed for the interaction of both compounds with the human α1-β2-γ2 GABAA (gamma-aminobutyric acid type A) receptor.

http://dx.doi.org/10.21577/0100-4042.20250079

Publicado online: novembro 26, 2024
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Total access: 119

Exploring internal standards and matrix matching for lanthanides determination in tea by LA-ICP-MS

Ana Caroline Vedovato RubinI; Vinicius Machado NevesI; Ana Barbosa VianaI; Taynara Bonfim RiquieriI; Dirce PozebonII;
Valderi Luiz DresslerI,*

A calibration procedure using internal standardization and matrix matching was established for lanthanides determination in tea by laser ablation-inductively coupled plasma mass spectrometry (LA-ICP-MS).

http://dx.doi.org/10.21577/0100-4042.20250078

Publicado online: novembro 22, 2024
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Total access: 122

Evaluation of thermal and mechanical properties of ZnSO4-B2O3-P2O5-Ho2O3 glass-ceramics

Areej S. AlqarniI,*; Ibrahim BulusII

For the first time, the thermal and mechanical properties of the promising composition of ZnSO4-B2O3-P2O5-Ho2O3 were determined.

http://dx.doi.org/10.21577/0100-4042.20250075

Publicado online: novembro 21, 2024
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Total access: 72

Determinação de ácido salicílico em leite utilizando spot test em papel e processamento de imagens digitais

Josiele Aparecida Magalhães Conrado; João Flávio da Silveira Petruci*

In this study, a simple, portable and low-cost analytical method for the determination of salycilic acid is presented. The reaction between the analyte and FeIII ions is used for salicylic acid (SA) recognition, and the quantification is based on the color information extracted by digital images.

http://dx.doi.org/10.21577/0100-4042.20250074

Publicado online: novembro 19, 2024
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Total access: 114

Computação quântica em química

Caio M. PortoI; Matheus S. FonsecaII; Guilherme de S. T. MoraisI; Celso J. Villas-BoasII; Rene A. NomeI; Nelson H. MorgonI,*

Quantum computing simulators can provide valuable insights into electronic structures, offering a significant step toward exact simulations using full-fledged quantum computers.

http://dx.doi.org/10.21577/0100-4042.20250072

Publicado online: novembro 14, 2024
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Total access: 118

Phytochemical profile, antioxidant and cytotoxic activities of leaf extract of Dipteryx lacunifera Ducke

Krislany A. L. Guedes AraujoI; Herbert G. SousaI; João P. da Silva GomesI; Renato Pinto de SousaI; Éverton L. de França FerreiraII,III; Monica T. PupoII; Pedro M. da Silva CostaIV; Claúdia PessoaIV; Mahendra RaiV; Mariana H. ChavesI,*; Gerardo Magela Vieira JuniorI,*

Electrospray ionization-ion trap mass spectrometry (ESI(-)-ITMS) and ultra-performance liquid chromatography coupled with electrospray ionization quadrupole-time-of-flight mass spectrometry (UPLC-ESI-QTOF-MS/MS) analysis of the fractions from leaves of Dipteryx lacunifera led to the annotation of twenty-one polar compounds (1-21). The antioxidant and cytotoxic potential of the ethyl acetate and ethereal fractions was also observed.

http://dx.doi.org/10.21577/0100-4042.20250070

Publicado online: novembro 13, 2024
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Total access: 154

Triflic acid-promoted regio and stereoselective synthesis of polyfunctionalized enaminones from dibenzylidene ketones and organic azides

Lucas Souza PratesI; Silvio CunhaI,II,*

Stereoselective synthesis of α-aryl enaminones was developed by TfOH-promoted cascade reactions via 1,3-dipolar cycloaddition of alkyl azides with dibenzylidene ketones, aziridine formation, and 1,2-aryl migration. Starting materials are readily available and TfOH is easy to handle.

http://dx.doi.org/10.21577/0100-4042.20250063

Publicado online: outubro 18, 2024
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Total access: 201

Effects of preparation method on catalytic behavior of Ni-Me (Me = Co, Nb)/γ-Al2O3 for oxidative dehydrogenation of ethane

Mario Hurtado CotilloI,II; José M. López NietoII; Benjamín SolsonaIII; Rosario Sun KouIV; Gino PicassoI,*

An alumina supported NiNb metal oxide prepared from hydrothermal method was successfully applied for ethane oxidative dehydrogenation (ODH) to ethylene. The hydrothermal method led to the feasible formation of active sites over the NiNb sample, which presented the highest selectivity toward ethylene due to the special nature of surface oxygen with low reducible sites.

http://dx.doi.org/10.21577/0100-4042.20250061

Publicado online: outubro 2, 2024
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Total access: 208

Two novel coumarin compounds: synthesis, in vitro antibacterial anticancer, and in silico docking and molecular dynamics

Le Thi Thanh TrucI; Nguyen Ngoc Huyen TranI; Nguyen Van ThoiI; Nguyen Van HueII; Nguyen Thi Hong AnhIII,*;
Tran Nguyen Minh AnI,*

Compounds 2 and 4 are novel via bromination. Compound 2 has inhibited well against Staphylococcus aureus and Bacillus cereus bacteria with minimal inhibitory concentration (MIC) values of 13.20 and 6.6 µM, respectively, and 2 inhibited stronger than parent compound 1.

http://dx.doi.org/10.21577/0100-4042.20250060

Publicado online: outubro 2, 2024
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Total access: 240

Determinação de biodiesel metílico de dendê em misturas com diesel utilizando a resolução multivariada de curvas com mínimos quadrados alternados

Edvando S. TelesI; Lucas G. da CostaI,*; Waldomiro Borges NetoI; Ricardo R. SoaresII

Multivariate curve resolution is used to quantify the content of palm oil methyl biodiesel in diesel blends. This tool recovers the pure profiles of analytes in complex mixtures, managing to determine the concentration of the species of interest even in the presence of interferents.

http://dx.doi.org/10.21577/0100-4042.20250057

Publicado online: setembro 19, 2024
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Total access: 192

The highly efficient BiOCl/KBiO3 p-n heterojunction photo-catalysts under visible light irradiation

Yan WangI,II; Qiong WuI; Van P. VuII; Beom S. ParkII; Shuo MaII; Heng Q. ZhangI,*

KBiO3 and BiOCl form the p-n heterojunction that makes the photo-induced electrons and holes efficiently separated and the recombination of electron-hole pairs hindered under visible light. Therefore, the photocatalytic effect can be greatly improved.

http://dx.doi.org/10.21577/0100-4042.20250056

Publicado online: setembro 17, 2024
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Total access: 229

Conversion rate control of TiCl4 hydrolysis to prepare nano TiO2

Qianjun LeI; Shengfei YuI,*; Wusheng LuoII

By using TiCl4 as the titanium source, we systematically determined the degree of hydrolysis of Ti4+ by adding triethanolamine (C6H15NO3) dropwise. By collecting solutions at different time points and performing UV spectroscopy analysis, we plotted the Ti4+ concentration over time. This study not only reveals the hydrolysis behavior of Ti4+ under different conditions, but also provides a theoretical basis and experimental method for the precise control of the hydrolysis process of Ti4+. Such research results have important guiding significance for the preparation and application of titanium-based materials.

http://dx.doi.org/10.21577/0100-4042.20250054

Publicado online: setembro 6, 2024
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Total access: 197

Comparative analysis of the fatty acid composition in human, cow and goat milk and their interpositional distribution in triacylglycerols

Giovanna C. A. FerreiraI; Patricia D. SantosII; Marcela S. ZangirolamiII; Alisson L. FigueiredoII; Cleverton S. FernandesII; Geovane A. R. da SilvaII; Ernani A. BassoII; Oscar O. SantosI,II,*

Comparison of fatty acids and triacylglycerols in human, cow, and goat milk as a basis for supplementation in infant formulas.

http://dx.doi.org/10.21577/0100-4042.20250052

Publicado online: setembro 4, 2024
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Total access: 241

Synthesis of palygorskite pellets for application in environmental remediation

Karla Mayara Arguelles SimõesI,II; Giullia Bertrand MarçanoII,III; Fernanda Arruda Nogueira Gomes SilvaIII; Luiz Carlos BertolinoII; Maira da Costa de Oliveira LimaIV; Lídia YokoyamaI

A new pelletization proposal allowed, from the solid state synthesis between the clay mineral palygorskite, lignin (paper pulp residue) and WAX®, the application of the composite in environmental remediation, removing 88.36% of PbII ions in 60 min and in batch system.

http://dx.doi.org/10.21577/0100-4042.20250051

Publicado online: agosto 30, 2024
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Total access: 270

Estudo computacional da influência de CO2 no empilhamento-π de monômeros de coroneno substituídos com enxofre

Kelly F. P. LaeberI,*; Leticia M. PratesII; Leonardo BaptistaIII; Maurício T. M. CruzI

The reinjection of CO2 into oil reservoirs as a mitigation project can influence asphaltene molecules. These structures can aggregate, precipitate, and cause several problems in the oil industry.

http://dx.doi.org/10.21577/0100-4042.20250050

Publicado online: agosto 26, 2024
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Total access: 266

Potencial de formação de ozônio na homologação veicular no bairro de Bangu, Rio de Janeiro

Renan Alves da Silva; Sergio Machado Corrêa*

Vehicles emit air pollutants, such as volatile organic compounds (VOC) and nitrogen oxides, which in the presence of sunlight, lead to the ozone formation. As ozone is the main product, it is a parameter used to control vehicular emission.

http://dx.doi.org/10.21577/0100-4042.20250046

Publicado online: agosto 6, 2024
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Total access: 251

Removal of deposits and improvement of shelf life in CO2-rich mineral water by ozone-microbubbles

Un Hwa ChoeI,*; Jong Hyon ChoeII; Yong Jun KimI

By injecting ozone microbubbles, it can effectively remove Fe2+ in CO2-rich mineral water to prevent sediment from occurring during storage and increase shelf life.

http://dx.doi.org/10.21577/0100-4042.20250045

Publicado online: agosto 6, 2024
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Total access: 208

Major inorganic ions in bulk precipitation from coastal urban and montane atlantic forest sites in southeastern Brazil

Patricia A. de SouzaI,*; William Z. de MelloII

Bulk precipitation samples collected at two coastal urban sites (downtown Niterói and APA Guapimirim) in the Metropolitan Region of Rio de Janeiro and at two montane Atlantic Forest (at 400 and 1000 m altitude) areas within Serra dos Órgãos National Park (PARNASO) were investigated for inorganic ions.

http://dx.doi.org/10.21577/0100-4042.20250044

Publicado online: julho 30, 2024
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Total access: 246

CHROMIUM SPECIATION IN ORGANIC FERTILIZERS BY SPECTROPHOTOMETRY

Arthur Felipe Burg; Graciela Marini Hiedrich; Ana Barbosa Viana; Valderi Luiz Dressler

Chromium VI is a highly toxic species and must be controlled in organic fertilizers. A simple spectrophotometric method was developed and validated for its determination.

http://dx.doi.org/10.21577/0100-4042.20250043

Publicado online: julho 25, 2024
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Total access: 260

A highly sensitive moisture-resistant btex sensor based on polyaniline nanofibers

Luyu WangI,*; Jia SongII; Chunyang YuIII

The quartz crystal microbalance (QCM) gas sensor based on polyaniline nanofibers has ultra-sensitive moisture-resistant detection capability for benzene, toluene, ethylbenzene, and xylene (BTEX) vapors.

http://dx.doi.org/10.21577/0100-4042.20250040

Publicado online: julho 17, 2024
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Total access: 294

Investigando o processo de criação da pintura "costureiras" de Tarsila do Amaral, de 1950, por imagens UVL, IR e MA-XRF

Elizabeth A. M. KajiyaI,*; Andre R. PimentaII; Valter S. FelixII; Nilton T. R. JuniorIII; Roberto da S. LiarthIII; Claudia R. F. de SouzaIII; Márcia BarbosaIV; Lucas C. MunizII; Robson B. dos SantosII; Leandro O. PereiraII; Elicardo A. S. GonçalvesI; Renato P. de FreitasII,*

This graphical abstract shows the ultraviolet-induced visible luminescence (UVL), infrared (IR) images and elemental maps Pb-L, Fe-K and Zn-K obtained in investigation of the painting "Costureiras", by Tarsila do Amaral, from 1950, oil on canvas, measuring 73.3 × 100.2 cm from MAC-USP Museum Collection.

http://dx.doi.org/10.21577/0100-4042.20250039

Publicado online: julho 17, 2024
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Total access: 306

Development and validation of a methodology for quantification of whey protein fractions in microparticulate ingredients

Igor L. de PaulaI; Carolina N. CunhaII; Caroline B. A. PintoI; Júlia M. P. M. VitralI; Paola F. LazzariniI; Juliana de C. da CostaII; Guilherme M. TavaresIII; Ítalo T. PerroneII; Luiz Fernando C. de OliveiraI; Rodrigo StephaniI,*

This study sought to develop an HPLC (high performance liquid chromatography) methodology to quantify the two main protein fractions of whey protein concentrates (WPC) in liquid and powdered form before and after microparticulation and at various protein concentrations. Additionally, we calculated the denaturation percentage of each protein fraction.

http://dx.doi.org/10.21577/0100-4042.20250038

Publicado online: julho 16, 2024
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Total access: 275

Chemical composition and biological activities of extracts and isolated compounds from the roots of Bowdichia virgilioides (Fabaceae)

Klauber Viana CardosoI; Darlan Coutinho dos SantosII; Jorge Mauricio DavidI,*

Chalcones, triterpenes, sitostenone, and very-long fatty acids were isolated from bioactive extracts of Bowdichia virgilioides’ roots.

http://dx.doi.org/10.21577/0100-4042.20250037

Publicado online: julho 12, 2024
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Total access: 350

Screening of Schinus terebinthifolia Raddi fruit by access of its functional properties, antioxidant and antimicrobial capacity and metal content

Maria C. da S. SauthierI, II,*; Walter N. L. dos SantosI, III; Jamile da C. CaldasI; Isaac M. de J. SilvaI; José J. C. L. de Souza JúniorI;
Lourdes C. de Souza NetaI; Luiz A. F. RibeiroI

High performance liquid chromatography-diode array detector (HPLC-DAD) and spectrophotometric methods were applied to determine bioactive phenolic compounds in Schinus terebinthifolia Raddi fruits. Antioxidant and antimicrobial activity were assessed. Metals were also determined by flame atomic absorption spectrometry (FAAS).

http://dx.doi.org/10.21577/0100-4042.20250036

Publicado online: julho 11, 2024
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Total access: 292

Efavirenz microcrystals for dissolution enhancement - fluid-bed granulation, scale-up, tableting and pharmacokinetics

Livia Deris PradoI,II; Isabella Costa Ramos de CastroI; Karen Medeiros GonçalvesI; Thamyrys Barreto ArgentaIII; Leandro TassoIII; Helvécio Vinícius Antunes RochaI,II,*

It was demonstrated a process improvement in the wet milling of efavirenz, increasing the concentration of solids in the suspension, and incorporating the powder into dispersible tablets.

http://dx.doi.org/10.21577/0100-4042.20250034

Publicado online: julho 5, 2024
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Total access: 321

Non-modified Pt electrodes enabling accurate voltammetric quantification of ammonia in water samples

Vitoria B. Messias; Regina M. Takeuchi; André L. Santos*

High concentrations of ammonia in natural waters indicate pollution and environmental degradation. In this study, we propose a simple, rapid, and cost-effective voltammetric method for quantifying NH3 in water samples using a non-modified Pt electrode.

http://dx.doi.org/10.21577/0100-4042.20250033

Publicado online: julho 3, 2024
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Total access: 337

Identification of quinolone-traizole hybrids as potential inhibitors using in silico approach

Syeda Abida EjazI,*; Aisha A. AlsfoukII; Tahira ShamimIII; Laila SumreenIV; Hafiz Kashif MahmoodI; Chen LiIV

7-Chloro-1-ethyl-6-fluoro-3-(5-oxo-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)quinolin-4(1H)-one (11e) as a potential multi-targeting agent against cholinestaeses (AChE and BChE) and monoamine oxidases (MAO-A and MAO-B) for the treatment of Alzheimer’s disease.

http://dx.doi.org/10.21577/0100-4042.20250032

Publicado online: julho 2, 2024
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Total access: 323

Pretreatment strategies for optimizing the lignocellulosic fractionation of pineapple peel residual biomass for energy purposes

Lara Beatriz Pereira de LimaI; Shirlene Kelly Santos CarmoII,*; José Mariano da Silva NetoII,; Stefani da Silva de MeloI; Flávio Luiz Honorato da SilvaIII

The pineapple peel biomass was subjected to chemical pretreatment experiments of organosolv delignification, and acid pretreatment with sulfuric acid (H2SO4) and hydrochloric acid (HCl), to enable the hydrolysis of hemicellulose and cellulose and obtain the fermentable sugars.

http://dx.doi.org/10.21577/0100-4042.20250030

Publicado online: junho 28, 2024
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Total access: 302

Passive-sampler employed for antifouling booster biocides analyses in seawater

Marta S. D. FreitasI; Rodrigo M. BatistaII; Andressa R. C. CostaI,*; Ozelito P. de Amarante JuniorI,II,; Teresa C. R. S. FrancoIII; Gilberto FillmannII; Natilene M. BritoI

Silicone rubbers were tested as passive samplers to determine the presence of third-generation antifouling biocides, commonly used as reinforcing agents in underwater paints. The chromatographic conditions provided an efficient separation and quantification of the analytes.

http://dx.doi.org/10.21577/0100-4042.20250028

Publicado online: junho 26, 2024
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Total access: 293

Fe-TiO2 with low quantity of iron extracted from (ilmenite) mining waste to the photocatalytic degradation of cyanide in water

Yuli Marcela Henao-HoyosI,II,*; Marco Antonio Márquez-GodoyII; José G. CarriazoI

Synthesis of Fe-TiO2 from natural ilmenite and its application in the photodecomposition of aqueous cyanide (FeTiO3).

http://dx.doi.org/10.21577/0100-4042.20250026

Publicado online: junho 25, 2024
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Total access: 320

Synthesis and characterization of substituted group controlled pyrene derivatives with radical cations

Shunjie LiI,*; Jian ChenII

Compound 1•+, which is the largest reported monoradical cation of thiophene-modified pyrene, has broad application prospects in the fields of semiconductors and optoelectronic materials.

http://dx.doi.org/10.21577/0100-4042.20250025

Publicado online: junho 25, 2024
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Total access: 325

Adsorption process of pesticide on SWCNT functionalized and crosslinked with chitosan using PM3 semi-empirical method and monte carlo simulation

Alfredo de Jesús-González; Norma Aurea Rangel-Vázquez*

Analysis of the adsorption process of different pesticides using functionalized single-walled carbon nanotubes (SWCNT) using the AMBER/PM3 hybrid method and Monte Carlo simulation.

http://dx.doi.org/10.21577/0100-4042.20250024

Publicado online: junho 25, 2024
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Total access: 304

Expired amoxicillin and penicillin v potassium tablets as the green corrosion inhibitor for lowcarbon steel in acetic acid solution containing chloride ions

Yongshun LiangI,II; Chaojie LeiI,II; Lang XuI,II; Ya LiI,II; Ting YangI,II; Junming GuoI,II; Mingwu XiangI,II; Wei BaiI,II,*

Expired amoxicillin and penicillin V potassium tablets form a protective film on the surface of the lowcarbon steel, reducing the direct contact between the steel and the corrosion solution, thus alleviating the corrosion of the steel.

http://dx.doi.org/10.21577/0100-4042.20250023

Publicado online: junho 25, 2024
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Total access: 268

Qualitative analysis of the shallow underground Waters of Benevides, Pará, based on multivariate statistical methods

Neuton T. Vasconcelos JuniorI,*; Paulo P. AraújoII; Kelson C. F. FaialI; Bruno S. CarneiroI

Interpretation of physical-chemical and chemical shallow groundwater quality for human consumption, using statistical techniques.

http://dx.doi.org/10.21577/0100-4042.20250021

Publicado online: junho 11, 2024
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Total access: 320

Composition, antioxidant capacity and antimicrobial activity of volatile organic compounds of Protium ovatum Eng. from different regions in Brazilian Savannah

Wendel C. de SousaI; Josemar G. Oliveira FilhoI; Alana K. PereiraII; Samara S. da SilvaIII; Giulia KassabIV; Marcela ChristofoliI; Cassia C. F. AlvesI; Andreia P. MatosV; Moacir Rossi ForimII; Cristiane de M. CazalVI,*

Volatile organic compounds extracted of Protium ovatum were collected in five different vegetation physiognomies of the Brazilian Cerrado and analyzed by GC-MS (gas chromatography coupled to mass spectrometry). Posteriorly, these were tested against Staphylococcus aureus, Escherichia coli, and Candida albicans. Chemometric tools were used.

http://dx.doi.org/10.21577/0100-4042.20250020

Publicado online: junho 7, 2024
PDF

Total access: 356

Performance of an environmental protection liner after laboratory UV exposure

Fernando Luiz LavoieI,*; Marcelo KobelnikI; Clever Aparecido ValentinI; Érica Fernanda da Silva TirelliII; Maria de Lurdes LopesIII; Jefferson Lins da SilvaI

In exposed geomembrane applications, polyethylene (PE) is in contact with ultraviolet (UV) radiation, and the degradation is led by photo-oxidation with several free radical reactions.

http://dx.doi.org/10.21577/0100-4042.20250019

Publicado online: junho 6, 2024
PDF

Total access: 349


Revisão

1T-MoS2: UMA BREVE REVISÃO DAS PROPRIEDADES E APLICAÇÕES DESTE POLIMORFO METÁLICO DO DISSULFETO DE MOLIBDÊNIO

Felipe Moreira Pinto; Felipe de Almeida La Porta; Fernando Wypych

Molybdenum disulfide (MoS2) occurs in three polymorphic/polytypic structures (1T, 2H and 3R) but only the polymorph 1T and the distorted phases 1T', 1T" and T"' present metallic properties and several applications in the most diverse areas.

http://dx.doi.org/10.21577/0100-4042.20250085

Publicado online: dezembro 9, 2024
PDF Informação suplementar

Total access: 60

Garantia de qualidade em metabolômica não-alvo

Andrew M. TeixeiraI; Julia Maia Galvão de QueirozI; Bruno C. GarridoII; Antônio Jorge R. SilvaI,*; Anelize BauermeisterIII;
Ricardo M. BorgesI

A workflow for analytical procedures promoting quality control and quality assurance in untargeted metabolomics.

http://dx.doi.org/10.21577/0100-4042.20250048

Publicado online: agosto 14, 2024
PDF

Total access: 259

Design bioinspirado de corantes

Paula Homem-de-MelloI,*; Ana Clara Gonzalez de SouzaI; Diêgo U. MeloI; Gabriel S. MolI; Jhonathan R. De SouzaI; Leonardo M. CarneiroI; Maíra G. NobregaI; Mateus ZanottoI; Raissa Lohanna G. Q. CorrêaI; Hueder P. M. de OliveiraI; Fernando H. BartoloniI; Yuri A. AotoII; Mauricio D. Coutinho-NetoI; Ednilsom OrestesI,III

Dyes of natural origin are an inspiration for the development of new molecules. Several computational methods can be used to deepen knowledge of these compounds' photophysical properties, from methods based on quantum mechanics to machine learning strategies.

http://dx.doi.org/10.21577/0100-4042.20250047

Publicado online: agosto 13, 2024
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Total access: 243


Nota Técnica

WaxAlly: new software to identify acyclic lipids from gas chromatography coupled to mass spectrometry data

Lucas Paradizo Roma*; Déborah Yara A. C. Santos

Wax lipids primarily consist of aliphatic acyclic compounds, which are often misidentified by Standard Digital Libraries. WaxAlly is a new software developed to assist in identifying the mass spectra of the main classes of wax lipids.

http://dx.doi.org/10.21577/0100-4042.20250049

Publicado online: agosto 16, 2024
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Total access: 192

Desenvolvimento e validação do software Adsorption Kinetics Calculation (AKC) para cálculos de parâmetros cinéticos de adsorção

Karinna Gomes Oliveira RodriguesI; Patrícia X. BalizaII; Douglas A. CastroI; Paulo Vitor Brandão LealII; Douglas Henrique PereiraI,III,*

Adsorption Kinetics Calculation (AKC) is a new free, easy-to-use software that uses non-linear equations to calculate adsorption kinetics parameters with precision, fast performance and a user-friendly interface.

http://dx.doi.org/10.21577/0100-4042.20250041

Publicado online: julho 19, 2024
PDF

Total access: 242

Device for calibrating electrochemical dissolved oxygen sensors

Marcus L. Sousa; Isabela A. Duran; Giovana V. Teixeira; André L. B. Formiga*

The invention aims to improve the calibration of gas sensors not covered by a membrane using a system for mixing solutions with different gas concentrations.

http://dx.doi.org/10.21577/0100-4042.20250031

Publicado online: julho 1, 2024
PDF STL FILES

Total access: 305


Educação

Laboratory electrochemistry "mystery box": from pre-service teachers' observations to inferences through predict-observe-explain strategy

Carla MoraisI,*; Cidália AndréI; Joana AlvesI; Gildo Girotto Jr.II

A "mystery box" laboratory activity incorporating technological resources designed to engage pre-service chemistry teachers in exploring electrochemical concepts through a predict-observe-explain strategy.

http://dx.doi.org/10.21577/0100-4042.20250077

Publicado online: novembro 22, 2024
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Total access: 105

Microscópio USB de baixo custo no laboratório didático de eletroquímica: dois experimentos clássicos sob um novo (micro) olhar

Aline Samara Lima de JesusI; Emerson Costa RiosI; Ana Cláudia KasseboehmerI,*; Ettore Paredes AntunesIII

Practical electrochemistry activities seen from an accessible microscopic perspective: water electrolysis and steel corrosion.

http://dx.doi.org/10.21577/0100-4042.20250073

Publicado online: novembro 19, 2024
PDF Informação suplementar

Total access: 123

A estrutura interna do campo da química no Brasil

Fernando CasellatoI; Luciana MassiII,*; Matheus Monteiro NascimentoIII

We show in this study that there is a strong hierarchy in the field of chemistry in Brazil. The dominant pole consists of researchers with high scientific capital and prestige. On the other side, we identified researchers with fewer resources and possibilities of raising the hierarchy.

http://dx.doi.org/10.21577/0100-4042.20250071

Publicado online: novembro 14, 2024
PDF

Total access: 87

Reutilização do ácido acetilsalicílico preparado nas aulas de química orgânica experimental como revelador de impressões digitais: uma aplicação no ensino de química

Caroline I. SilveiraI,II; Samuel A. PereiraI,II; Victoria B. V. de LeonI; Jeanifer T. CamachoI; Amanda F. LeitzkeI; Rogério A. FreitagI; Claudio M. P. de PereiraI; Bruno N. da RosaI,II,*

The acetylsalicylic acid produced in the experimental classes, which would typically be discarded, is recycled through purification and characterization for later use as a fingerprint developer.

http://dx.doi.org/10.21577/0100-4042.20250062

Publicado online: outubro 8, 2024
PDF

Total access: 214

Proposta de síntese one-pot: práticas experimentais de química orgânica e medicinal a partir da preparação do heterociclo tiazol

Arlan de Assis GonsalvesI,II; Victória Laysna dos Anjos SantosIII; Sidney Silva SimplicioII; Délis Galvão GuimarãesIII; Cleônia Roberta Melo AraújoI,IV,*

Graphical summary of the theoretical aspects (one-pot synthesis) that will be explored in this work, which aims to contribute to the chemistry teaching in Brazilian higher education.

http://dx.doi.org/10.21577/0100-4042.20250059

Publicado online: setembro 27, 2024
PDF Informação suplementar

Total access: 195

(Re)pensando as (in)diferenças: temas transversais como possibilidade para as aulas de química

Mariana S. M. dos Santos; Tania D. M. Salgado*

Chemistry education focused on citizenship education, ethics in interpersonal relationships and mainly criticism of social and cultural inequalities.

http://dx.doi.org/10.21577/0100-4042.20250055

Publicado online: setembro 13, 2024
PDF

Total access: 169

A argumentação em diagramas heurísticos elaborados por graduandos em química a partir da resolução de problemas de caráter experimental

Cleane C. Paz*; Luciana N. A. Ferreira

The construction of arguments by solving experimental problems with the help of the heuristic diagram.

http://dx.doi.org/10.21577/0100-4042.20250042

Publicado online: julho 24, 2024
PDF

Total access: 227

Uma proposta didático-pedagógica utilizando um software livre para interpretar a PCA

Rebeca Fernanda de Souza e Silva; Natália Neves Macedo Deimling; Patrícia Valderrama*

How to interpret it? Perform a PCA (principal component analysis). And, how to interpret the PCA results?

http://dx.doi.org/10.21577/0100-4042.20250027

Publicado online: junho 26, 2024
PDF Informação suplementar
Video

Total access: 297

Implicações formativas para a atuação de professores de química da educação básica em relação à temática radioatividade

Luclécia D. NunesI; Nyuara A. S. MesquitaII,*

The training of Chemistry teachers by higher education institution in the state of Goiás in relation to radioactivity presents gaps that reverberate in the teacher's performance in basic education.

http://dx.doi.org/10.21577/0100-4042.20250022

Publicado online: junho 11, 2024
PDF Informação suplementar

Total access: 301


Assuntos Gerais

MEDICINAL CHEMISTRY IN POPULAR CULTURE: AN ANALYSIS OF THE REPRESENTATION OF BIOACTIVE SUBSTANCES IN CARTOONS AND GAMES

Aldo S. de Oliveira; Angelica Justino; Thiago H. Doring; Vanessa Nascimento

This study explores how bioactive substances are depicted in popular culture, particularly in cartoons and games, through the perspective of Medicinal Chemistry.

http://dx.doi.org/10.21577/0100-4042.20250088

Publicado online: dezembro 20, 2024
PDF

Total access: 11

JOSÉ ISRAEL VARGAS: ESSÊNCIAS DA VIDA E OBRA DE UM LÍDER DA CIÊNCIA NO BRASIL

Luiz C. A. Barbosa; Luciano E. Faria; José D. Fabris

Essential facts and circumstances of José Israel Vargas' outstanding career, over seven decades, are highlighted. These comprise his scientific research time at Centre d´Études Nucléares de Genoble (CENG), France, his work at Federal University of Minas Gerais (UFMG), and his lively involvement in ruling Brazilian science policy.

http://dx.doi.org/10.21577/0100-4042.20250087

Publicado online: dezembro 10, 2024
PDF Informação suplementar

Total access: 96

Humphry davy nas páginas de periódicos brasileiros do início do século XIX

Luiz C. A. Barbosa*; Pedro G. M. Gomes; Carlos A. L. Figueiras

In the early 19th century, the arrival of the Portuguese court in Brazil fostered an intellectual elite interested in science. This article illustrates their interest through the analysis of the works of Humphry Davy which appeared in Brazilian periodicals during that time.

http://dx.doi.org/10.21577/0100-4042.20250076

Publicado online: novembro 22, 2024
PDF

Total access: 201

Programas de aceleração de tecnologias químicas em universidades: importância para a formação de químicos empreendedores, licenciamento de tecnologias e criação de startups

Yasmim Rodrigues dos Santos; Rafaela Leal Pereira; Eduarda Rezende Barbosa; Ana Paula de Carvalho Teixeira;
Rochel Montero Lago*; Fabiano Gomes Ferreira de Paula*

In this article, we present a ChemTech acceleration program where the academic participants (researchers and students) develop entrepreneurial skills while taking their chemical technologies from universities to the market/industry.

http://dx.doi.org/10.21577/0100-4042.20250058

Publicado online: setembro 24, 2024
PDF

Total access: 166

Profa. Dra. Ana Rosa Kucinski Silva

Dalva L. A. de FariaI,II,*

Ana Rosa Kucinski Silva, lecturer in the Department of Chemistry at the University of São Paulo, was kidnapped and murdered in 1974 by the Brazilian military dictatorship (1964-1985). Very little is known about her academic activities. This work aims to contribute to fill this gap.

http://dx.doi.org/10.21577/0100-4042.20250053

Publicado online: setembro 4, 2024
PDF

Total access: 202

Processo de inovação para tecnologias químicas nascidas em universidades: ações do Laboratório Escalab-UFMG

Thamires Luciana Braz Alves*; Ana Paula de Carvalho Teixeira; Breno Germano de Freitas Oliveira; Luísa Carolina Andrade Barbosa; Maria Paula Duarte de Oliveira; Rochel Montero Lago*

Escalab is a chemical technology and innovation lab at Universidade Federal de Minas Gerais (UFMG) structured to take technologies to the market and connect academy-industry focused on scale up, business modeling and startup creation.

http://dx.doi.org/10.21577/0100-4042.20250035

Publicado online: julho 8, 2024
PDF

Total access: 230

A equação de nernst: origens e contexto termodinâmico

Douglas C. Silva; Emilio Borges*

One of the most important equations in the history of chemistry. It represents the culmination of decades of conceptual and experimental evolution in the field of electrochemical systems and still today stands as one of the pillars of modern electrochemistry.

http://dx.doi.org/10.21577/0100-4042.20250029

Publicado online: junho 27, 2024
PDF

Total access: 309

On-line version ISSN 1678-7064 Printed version ISSN 0100-4042
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