Recent Papers - Machine Learning Special Issue
Reviews/Accounts - last 5 years
With a suitable cetyltrimethylammonium bromide (CTAB) model, we carried out molecular dynamics (MD) calculations that were able to describe most of the surfactant behavior as aggregates (micelles) in aqueous solution, as well as its interaction and molecular arrangement pattern on gold surface. Details are presented in the Article Molecular Dynamics Simulations of Cetyltrimethylammonium Bromide (CTAB) Micelles and their Interactions with a Gold Surface in Aqueous Solution by José Adriano da Silva, Roberta P. Dias, Gabriel C. A. da Hora, Thereza A. Soares and Mario R. Meneghetti on page 191.
José Adriano da Silva; Roberta P. Dias; Gabriel C. A. da Hora; Thereza A. Soares; Mario R. Meneghetti
How to cite this articleWith a suitable cetyltrimethylammonium bromide (CTAB) model, we carried out molecular dynamics (MD) calculations that were able to describe most of the surfactant behavior as aggregates (micelles) in aqueous solution, as well as its interaction and molecular arrangement pattern on gold surface. Details are presented in the Article Molecular Dynamics Simulations of Cetyltrimethylammonium Bromide (CTAB) Micelles and their Interactions with a Gold Surface in Aqueous Solution by José Adriano da Silva, Roberta P. Dias, Gabriel C. A. da Hora, Thereza A. Soares and Mario R. Meneghetti on page 191.
Jian Wang; Lili Tian; Yanan Yan; Yaru Liu; Yan Zhang; Chun Yang
How to cite this article
In this paper we describe the synthesis of estradiol templated magnetic molecularly imprinted cryogel. The excellent selective adsorption performance, solid phase extraction and chromatographic performances of the MMIC (magnetic molecularly imprinted cryogel) were investigated.
Diego A. S. Carrero; Pedro H. J. Batista; Luciana G. S. Souza; Francisco C. L. Pinto; Mayron A. de Vasconcelos; Edson H. Teixeira; Kirley M. Canuto; Gilvandete M. P. Santiago; Edilberto R. Silveira; Otília D. L. Pessoa
How to cite this article
Five new withanolides, in addition to six others previously reported, were isolated and characterized from the leaf acetone extract of Nicandra physalodes.
Julia R. L. Freitas; Pedro H. Vendramini; Júlio O. F. Melo; Marcos N. Eberlin; Rodinei Augusti
How to cite this article
Chemical images of carbohydrates and amino acids/ureides generated from Mentha x piperita leaves at distinct maturation stages and obtained upon the application of the desorption electrospray ionization mass spectrometry imaging (DESI-MSI) technique.
Mônica A. Neves; Gilmar S. Silva; Natilene M. Brito; Karla C. M. Araújo; Edmar P. Marques; Lanna K. Silva
How to cite this article
Analytical methodology for the determination of antibiotics in mangrove sediments in an estuarine system.
Ding Wang; Qinfu Liu; Dandan Hou; Shuai Zhang; Peng Guo; Hongfei Cheng
How to cite this article
Schematic representation of the transformation from Kaol to Kaol-BTAC. The time required for preparation of methoxy-modified Kaol was shortened by more than fifty percent, and the obtained products could be used for further process without any negative impact.
Julianna M. Vagula; Nayane M. Sinosaki; Marcos A. S. Ribeiro; Thiago Magon; Janksyn Bertozzi; Eduardo C. Meurer; Oscar O. Santos Junior; Jesuí V. Visentainer
How to cite this article
This work aim is to identify and quantify three different anthocyanidins in six different berries and shows the elucidation of a general fragmentation mechanism.
Guilherme M. D. Ferreira; Gabriel M. D. Ferreira; Maria C. Hespanhol; Alvaro J. P. Agudelo; Jaqueline P. Rezende; Ana C. S. Pires; Luis H. M. Silva
How to cite this article
Acetonitrile and N,N-dimethylformamide modify the water tridimensional structure in the solvation shells of sodium alkyl sulfates and poly(ethylene oxide) without altering the relative stability of the surfactant aggregates formed in the absence and in the presence of the polymer.
Paula C. Arroyo-Martínez; Norma A. Sánchez-Flores; María E. Villafuerte-Castrejón; Rodrigo Vivar-Ocampo
How to cite this article
4A zeolite synthesized from rice husk by microwave-assisted hydrothermal synthesis without aging time increases the effect of the antistripping additive.
Junjie Wang; Jing Cheng; Yu Zhou; Lei Meng; Yuehua Wang; Xiaoqian Ren; Jinhua Liang; Min Jiang
How to cite this article
The HPW/Zn-Ti layered double hydroxides exhibited remarkable catalytic performance in the epoxidation of fatty acid methyl ester with H2O2.
Maísa B. Costa; Marcos P. Martins; Hugo C. de Araújo; Inês S. Resck
How to cite this article
A new synthetic methodology is demonstrated to obtain potential precursors that may lead to the synthesis of (±)-pyrenophorin through the use of a convenient oxidative ring expansion.
Jiuyu Chen; Baozhong Zhu; Yunlan Sun; Shoulai Yin; Zicheng Zhu; Jiaxin Li
How to cite this article
Catalytic activity profiles of 10FexMn/AC (x = 1, 3, 5) catalysts with different Fe and Mn molar ratios.
Han Xiaoxiang; Kuang Yingying; Xiong Chunhua; Tang Xiujuan; Chen Qing; Wang Kuiwu; Hung Chin-Te; Liu Li-Li; Liu Shang-Bin
How to cite this article
Phosphotungstic acid supported ceria shows excellent catalytic activity for oxidation of benzyl alcohol to benzaldehyde due to Bronsted-Lewis acid synergy effect.
Luis P. Icart; Edson Fernandes; Lissette Agüero; Maelia Z. Cuesta; Dionisio Z. Silva; Daniel E. Rodríguez-Fernández; Fernando G. Souza Jr.; Luis Maurício T. R. Lima; Marcos L. Dias
How to cite this article
Ring opening polymerization initiated by tin(II) 2-ethylhexanoate was used to introduce salicyl aldehyde and salicylic acid end groups in poly(lactic acid).
Mariana A. A. Aleixo; Taís M. Garcia; Diego B. Carvalho; Luiz H. Viana; Marcos S. Amaral; Najla M. Kassab; Marilin C. Cunha; Indiara C. Pereira; Palimécio G. Guerrero Jr.; Renata T. Perdomo; Maria F. C. Matos; Adriano C. M. Baroni
How to cite this article
In this work, twelve novel 1,2,3-triazole retinoids analogues of tamibarotene (AM80) were synthesized, and biological activity was evaluated against human cancer cells.
Shouai Feng; Hong Liu; Jiangfeng Huang; Jingjing Wu; Kang Wei; Xiaolan Li; Dongling Meng; Jiao Zhao; Yaling Yang
How to cite this article
Nonanoic acid-coated magnetic Fe3O4 nanoparticles were used as adsorbents for preconcentration and separation of Cu and Pb. Methanol-nitric acid was used as eluent for desorption of Cu and Pb, finally detected by flame atomic absorption spectrometry.
Andressa Esteves-Souza; Kenia Pissinate; Maria A. M. Maciel; Aurea Echevarria
How to cite this article
Synthesis of new trans-dehydrocrotonin nitrogenated derivatives, and in vitro evaluation of cytotoxic, and DNA-topoisomerase I activities.
This paper is part of the PubliSBQ Special Issue in honor of the late Prof Angelo da Cunha Pinto.
Amanda M. P. Santos; Alexandre C. Bertoli; Ana Carolina C. P. Borges; Raphael A. B. Gomes; Jerusa S. Garcia; Marcello G. Trevisan
How to cite this article
The humic and fulvic acids extracted from poultry manure are complexed in Cu2+, Zn2+ and Fe2+ and taken to a release test in contact with buffer solution.
Luana O. Santos; Fernanda F. Silva; Lidiane C. Santos; Ingred S. C. Carregosa; Alberto Wisniewski Jr.
How to cite this article
Invasive aquatic plants like water hyacinth is one of the major rapid growth plant in the planet and represent a water environmental problem. Through micropyrolysis experiments we can evaluate the potential to use this biomass to produce biofuels or fine chemicals.
Antonia C. R. F. Medeiros; Julio C. Borges; Klaus M. Becker; Raquel F. Rodrigues; Leonor L. Leon; Marilene Canto-Cavalheiro; Alice M. R. Bernardino; Marcos C. de Souza; Leandro F. Pedrosa
How to cite this article
1H-Pyrazolo[3,4-b] pyridine phosphoramidates were synthesized and evaluated against Leishmania amazonensis promastigotes in vitro.
Patrícia M. Sanchez; Elis D. Pauli; Guilherme L. Scheel; Miroslava Rakocevic; Roy E. Bruns; Ieda S. Scarminio
How to cite this article
Coffea arabica L. leaf extracts, grown under different environmental conditions, were analyzed by FTIR with chemometric tools. It was possible to discriminate leaves from different microclimates by bands related to carbohydrates, amino acids, lipids and caffeine.
John E. Díaz; Diana C. Martinez; Lina V. López; Gina M. Mendez; Ricardo Vera; Alix E. Loaiza
How to cite this article
The synthesis of a series of O-alkyl oximes of flavone and 6-hydroxyflavone using a simple experimental protocol is reported. Cytotoxicity of all compounds was evaluated against MDA-MB-231, PC-3, A-549 and MRC-5 cells. The best IC50 value was obtained for 6-hydroxyflavone (3.4 μM) against MDA-MB-231.
Gerffeson S. dos Santos; Laiana O. B. Silva; Aníbal F. Santos Júnior; Erik G. P. da Silva; Walter N. L. dos Santos
How to cite this article
The inorganic antimony speciation in natural waters was evaluated by hydride generation atomic fluorescence spectrometry (HG AFS).
José Adriano da Silva; Roberta P. Dias; Gabriel C. A. da Hora; Thereza A. Soares; Mario R. Meneghetti
How to cite this article
MD simulations of: CTAB micelles in water (left) and CTAB micelles adsorbed on a gold surface in aqueous solution (right).
Matthieu Tubino; Arnaldo G. Oliveira Júnior; Acacia A. Salomao
How to cite this article
The image shows the system used to continuously monitor the transesterification reaction.
Fabiane C. Petry; Adriana Z. Mercadante
How to cite this article
A new fast methodology for extraction and quantitative analysis of carotenoids from freeze-dried orange and mango pulps was developed and validated. A detailed identification and quantification, by HPLC-DAD-MS/MS, of carotenoids detected in such matrices are also given.
Online version ISSN 1678-4790 Printed version ISSN 0103-5053
Journal of the Brazilian Chemical Society
JBCS Editorial and Publishing Office
University of Campinas - UNICAMP
13083-970 Campinas-SP, Brazil
Free access