Interactions of Co, Cu, and non-metal phthalocyanines with external structures of SARS-CoV-2 using docking and molecular dynamics
Alencar, Wilson Luna Machado, da Silva Arouche, Tiago, Neto, Abel Ferreira Gomes, de Castro Ramalho, Teodorico, de Carvalho Júnior, Raul Nunes, de Jesus Chaves Neto, Antonio Maia
Published in Scientific reports (28.02.2022)
Published in Scientific reports (28.02.2022)
Get full text
Journal Article
Molecular interactions of the Omicron, Kappa, and Delta SARS-CoV-2 spike proteins with quantum dots of graphene oxide
da Silva Arouche, Tiago, Lobato, Julio Cesar Mendes, dos Santos Borges, Rosivaldo, de Oliveira, Mozaniel Santana, de Jesus Chaves Neto, Antonio Maia
Published in Journal of molecular modeling (01.07.2024)
Published in Journal of molecular modeling (01.07.2024)
Get full text
Journal Article
Publisher Correction: Interactions of Co, Cu, and non-metal phthalocyanines with external structures of SARS-CoV-2 using docking and molecular dynamics
Alencar, Wilson Luna Machado, da Silva Arouche, Tiago, Neto, Abel Ferreira Gomes, de Castro Ramalho, Teodorico, de Carvalho Júnior, Raul Nunes, de Jesus Chaves Neto, Antonio Maia
Published in Scientific reports (14.03.2022)
Published in Scientific reports (14.03.2022)
Get full text
Journal Article
Phytochemical profile, antioxidant activity, inhibition of acetylcholinesterase and interaction mechanism of the major components of the Piper divaricatum essential oil obtained by supercritical CO2
de Oliveira, Mozaniel Santana, da Cruz, Jorddy Neves, Gomes Silva, Sebastião, da Costa, Wanessa Almeida, de Sousa, Sérgio Henrique Brabo, Bezerra, Fernanda Wariss Figueiredo, Teixeira, Edinaldo, da Silva, Nayara Janaína Neves, de Aguiar Andrade, Eloisa Helena, de Jesus Chaves Neto, Antonio Maia, de Carvalho, Raul Nunes
Published in The Journal of supercritical fluids (01.03.2019)
Published in The Journal of supercritical fluids (01.03.2019)
Get full text
Journal Article
Chemical profile of Lippia thymoides, evaluation of the acetylcholinesterase inhibitory activity of its essential oil, and molecular docking and molecular dynamics simulations
Silva, Sebastião Gomes, da Costa, Renato Araújo, de Oliveira, Mozaniel Santana, da Cruz, Jorddy Neves, Figueiredo, Pablo Luis B, Brasil, Davi do Socorro Barros, Nascimento, Lidiane Diniz, Chaves Neto, Antônio Maia de Jesus, de Carvalho Junior, Raul Nunes, Andrade, Eloisa Helena de Aguiar
Published in PloS one (08.03.2019)
Published in PloS one (08.03.2019)
Get full text
Journal Article
Exploring the Potential of Myrcia Genus Essential Oils: A Review of Biological Activities and Recent Advances
dos Santos, Eliza de Jesus Barros, Bezerra, Fernanda Wariss Figueiredo, da Silva, Luiz Renan Ramos, da Silva, Marcilene Paiva, Ferreira, Oberdan Oliveira, da Silva Ma, de Jesus Chaves-Neto, Antônio Maia, de Santana Botelho, Anderson, Kumar, Ravendra, Bargali, Pooja, do Socorro de Souza Vilhena, Karyme, de Aguiar Andrade, Eloisa Helena, de Oliveira, Mozaniel Santana
Published in Molecules (Basel, Switzerland) (01.06.2024)
Published in Molecules (Basel, Switzerland) (01.06.2024)
Get full text
Journal Article
Heavy Metals Nanofiltration Using Nanotube and Electric Field by Molecular Dynamics
Filho, Tarciso Andrade, Pereira, Tais Sousa de Sa, Tanoue, Phelipe Seiichi Martins, Cavaleiro, Rosely Maria dos Santos, Arouche, Tiago da Silva, Neto, A. M. J. C.
Published in Journal of nanomaterials (2020)
Published in Journal of nanomaterials (2020)
Get full text
Journal Article
Density functional theory for the thermodynamic gas-phase investigation of butanol biofuel and its isomers mixed with gasoline and ethanol
Martins, Marcelo Gonçalves, da Silva Arouche, Tiago, Neto, Abel Ferreira Gomes, da Cruz, Jorddy Neves, da Costa, Fabio Luiz Paranhos, Fernandes, Lindemberg Lima, de Carvalho Junior, Raul Nunes, da Silva Costa, José Francisco, de Jesus Chaves Neto, Antonio Maia
Published in Journal of molecular modeling (11.02.2021)
Published in Journal of molecular modeling (11.02.2021)
Get full text
Journal Article
Effect of chitosan/albendazole nanocarriers’ solvation by molecular dynamics
da Silva Costa, Ana Carolina, Carvalho, Saulo Cardoso, de Farias Silva, Natália, do Nascimento-Júnior, Antônio Edilson Sousa, Cruz, Jorddy Neves, de Jesus Chaves Neto, Antônio Maia, do Socorro Barros Brasil, Davi, Silva-Júnior, José Otávio Carréra, Ribeiro-Costa, Roseane Maria
Published in Theoretical chemistry accounts (01.07.2020)
Published in Theoretical chemistry accounts (01.07.2020)
Get full text
Journal Article
Combined application of DP4+ and ANN‐PRA to determine the relative configuration of natural products: The alpha‐bisabol case study
Santos, Fernando Martins, Silva Mota, Gunar Vingre, Martorano, Lucas Haidar, Albuquerque, Ana Carolina Ferreira, Silva, Claudinei Alves, Silva, Adalberto Manoel, Jesus Chaves Neto, Antônio Maia, Valverde, Alessandra Leda, Cardoso, Evani Ferreira, Costa, Fabio Luiz Paranhos
Published in Magnetic resonance in chemistry (01.06.2022)
Published in Magnetic resonance in chemistry (01.06.2022)
Get full text
Journal Article
Sugar moiety has a synergistic effect on hydroxylated xanthone for better antioxidant activity of mangiferin
da Veiga, Andrex Augusto Silva, de Jesus Chaves Neto, Antonio Maia, da Silva, Albérico Borges Ferreira, Herculano, Anderson Manoel, Oliveira, Karen Renata Matos, dos Santos Borges, Rosivaldo
Published in Medicinal chemistry research (01.04.2018)
Published in Medicinal chemistry research (01.04.2018)
Get full text
Journal Article
Chemical Composition, Antimicrobial Properties of Siparuna guianensis Essential Oil and a Molecular Docking and Dynamics Molecular Study of its Major Chemical Constituent
Santana de Oliveira, Mozaniel, da Cruz, Jorddy Neves, Almeida da Costa, Wanessa, Silva, Sebastião Gomes, Brito, Mileide da Paz, de Menezes, Sílvio Augusto Fernandes, de Jesus Chaves Neto, Antônio Maia, de Aguiar Andrade, Eloisa Helena, de Carvalho Junior, Raul Nunes
Published in Molecules (Basel, Switzerland) (25.08.2020)
Published in Molecules (Basel, Switzerland) (25.08.2020)
Get full text
Journal Article
Interactions between carbon nanotubes and external structures of SARS-CoV-2 using molecular docking and molecular dynamics
Lobato, Júlio Cesar Mendes, Arouche, Tiago da Silva, Nero, Jordan Del, Filho, TarcisoAndrade, Borges, Rosivaldo dos Santos, Neto, Antonio Maia de Jesus Chaves
Published in Journal of molecular structure (15.08.2023)
Published in Journal of molecular structure (15.08.2023)
Get full text
Journal Article
Hormones Nanofiltration in Carbon Nanotubes and Boron Nitride Nanotubes Using Uniform External Electric Field Through Molecular Dynamics
Dos Santos Cavaleiro, Rosely Maria, da Silva Arouche, Tiago, Martins Tanoue, Phelipe Seiichi, Sá Pereira, Tais Souza, de Carvalho Junior, Raul Nunes, Paranhos Costa, Fabio Luiz, de Andrade Filho, Tarciso Silva, Dos Santos Borges, Rosivaldo, de Jesus Chaves Neto, Antonio Maia
Published in Journal of nanoscience and nanotechnology (01.11.2021)
Published in Journal of nanoscience and nanotechnology (01.11.2021)
Get more information
Journal Article
A Combined Molecular Docking and Density Functional Theory Nuclear Magnetic Resonance Study of Trans-Dehydrocrotonin Interacting with COVID-19 Main Protease and Severe Acute Respiratory Syndrome Coronavirus 2 3C-Like Protease
Cardoso, Evani Ferreira, Giacomello, Thaís Forest, Rocha de Oliveira, Leandro Leal, da Silva, Tiago Arouche, de Jesus Chaves Neto, Antonio Maia, Da Silva Mota, Gunar Vingre, Souza Siqueira, Marcelo Ricardo, Paranhos Costa, Fabio Luiz
Published in Journal of nanoscience and nanotechnology (01.11.2021)
Published in Journal of nanoscience and nanotechnology (01.11.2021)
Get more information
Journal Article
SARS-CoV-2 external structures interacting with nanospheres using docking and molecular dynamics
Martins da Silva, Anderson Yuri, Arouche, Tiago da Silva, Siqueira, Marcelo Ricardo Souza, Ramalho, Teodorico Castro, de Faria, Lenio Jose Guerreiro, Gester, Rodrigo do Monte, Carvalho Junior, Raul Nunes de, Santana de Oliveira, Mozaniel, Neto, Antonio Maia de Jesus Chaves
Published in Journal of biomolecular structure & dynamics (15.09.2023)
Published in Journal of biomolecular structure & dynamics (15.09.2023)
Get full text
Journal Article
A Utilização dos Símbolos Musicais para o Ensino de Matemática / The Use of Musical Symbols for Teaching Mathematics
Lobato, Marinaldo Carvalho, Lobato Júnior, José Maria dos Santos, Chaves Neto, Antonio Maia de Jesus, Mendes, Rodinely Serrão, De Souza, Tatiane Cardoso, Pantoja, Leonardo Carlos Rodrigues, De Souza, Elissanta Pinheiro, Costa, José Francisco da Silva
Published in Brazilian Journal of Development (10.09.2021)
Published in Brazilian Journal of Development (10.09.2021)
Get full text
Journal Article
13C NMR Chemical Shift Calculation Applied to Differentiation of Regioisomers Triterpenes
Alves de Morais Rocha, Rênica, Forest Giacomello, Thaís, Maia de Jesus Chaves Neto, Antonio, Vingre da Silva Mota, Gunar, Luiz Paranhos Costa, Fabio
Published in Revista Virtual de Química (2020)
Published in Revista Virtual de Química (2020)
Get full text
Journal Article
Cover Picture: DFT Study of L‐Cysteine Fragmentation Route using a Novel Protocol (ChemistrySelect 2/2020)
Oliveira, Carlos Xavier, Mocellin, Alexandra, Menezes de Souza Lima, Fabio, Jesus Chaves Neto, Antonio Maia, Lima Azevedo, David
Published in ChemistrySelect (Weinheim) (16.01.2020)
Published in ChemistrySelect (Weinheim) (16.01.2020)
Get full text
Journal Article
O ENSINO DE MATRIZES E APLICABILIDADE EM SEQUÊNCIAS DIDÁTICAS INTEGRADO AO ENSINO TRADICIONAL / MATRIX TEACHING AND APPLICABILITY IN DIDACTIC SEQUENCES INTEGRATED WITH TRADITIONAL TEACHING
Corrêa, Tonival de Sarges, Costa, José Francisco da Silva, Junior, José Maria dos Santos Lobato, Neto, Antonio Maia de Jesus Chaves, Lobato, Marinaldo Carvalho, Mendes, Rodinely Serrão, Pantoja, Leonardo Carlos Rodrigues, Cabral, Natanael Freitas
Published in Brazilian Journal of Development (2021)
Published in Brazilian Journal of Development (2021)
Get full text
Journal Article