Theoretical Studies Aimed at Finding FLT3 Inhibitors and a Promising Compound and Molecular Pattern with Dual Aurora B/FLT3 Activity
Fernandes, Ítalo Antônio, Braga Resende, Déborah, Ramalho, Teodorico Castro, Kuca, Kamil, da Cunha, Elaine Fontes Ferreira
Published in Molecules (Basel, Switzerland) (09.04.2020)
Published in Molecules (Basel, Switzerland) (09.04.2020)
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Journal Article
Effect of drug metabolism in the treatment of SARS-CoV-2 from an entirely computational perspective
de Jesus, João Paulo Almirão, Assis, Letícia Cristina, de Castro, Alexandre Alves, da Cunha, Elaine Fontes Ferreira, Nepovimova, Eugenie, Kuca, Kamil, de Castro Ramalho, Teodorico, de Almeida La Porta, Felipe
Published in Scientific reports (07.10.2021)
Published in Scientific reports (07.10.2021)
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Journal Article
Inhibition of α‐Glycosidase by Lippia dulcis Trevir. (Verbenaceae) Preparations, Quantification of Verbascoside, and Study of Its Molecular Docking
Ritter Ruas, Natalia, Carvalho Pereira, Aline, Lopes Silva Pereira, Luciana, Mesquita Germano, Carolina, Fontes Ferreira da Cunha, Elaine, Alves de Carvalho, Alexandre, Alves Lameira, Osmar, Eduardo Brasil Pereira Pinto, José, Kelly Vilela Bertolucci, Suzan
Published in Chemistry & biodiversity (01.02.2023)
Published in Chemistry & biodiversity (01.02.2023)
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Journal Article
QSAR Study of N -Myristoyltransferase Inhibitors of Antimalarial Agents
Santos-Garcia, Letícia, de Mecenas Filho, Marco Antônio, Musilek, Kamil, Kuca, Kamil, Ramalho, Teodorico Castro, da Cunha, Elaine Fontes Ferreira
Published in Molecules (Basel, Switzerland) (13.09.2018)
Published in Molecules (Basel, Switzerland) (13.09.2018)
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Journal Article
Mitochondriotropic action and DNA protection: Interactions between phenolic acids and enzymes
Abreu, Tatiane Silva, Braga, Mariana Aparecida, Simão, Anderson Assaid, Trento, Marcus Vinicius Cardoso, Eleutério, Mateus Willian de Faria, Silva Pereira, Luciana Lopes, Cunha, Elaine Fontes Ferreira, Marcussi, Silvana
Published in Journal of biochemical and molecular toxicology (01.01.2020)
Published in Journal of biochemical and molecular toxicology (01.01.2020)
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Journal Article
Theoretical structural and electronic analyses with emphasis on the reactivity of iron oxide prototypes in methane C–H bond activation
Silva, Telles Cardoso, de Almeida, Katia Júlia, dos Santos Pires, Maíra, de Castro, Alexandre Alves, Gonçalves, Mateus Aquino, da Cunha, Elaine Fontes Ferreira, Ramalho, Teodorico Castro
Published in Reaction kinetics, mechanisms and catalysis (01.02.2017)
Published in Reaction kinetics, mechanisms and catalysis (01.02.2017)
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Journal Article
Application of 4D-QSAR studies to a series of raloxifene analogs and design of potential selective estrogen receptor modulators
Sodero, Ana Carolina Rennó, Romeiro, Nelilma Correia, da Cunha, Elaine Fontes Ferreira, de Oliveira Magalhaães, Uiaran, de Alencastro, Ricardo Bicca, Rodrigues, Carlos Rangel, Cabral, Lúcio Mendes, Castro, Helena Carla, Albuquerque, Magaly Girão
Published in Molecules (Basel, Switzerland) (15.06.2012)
Published in Molecules (Basel, Switzerland) (15.06.2012)
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Journal Article
3D-QSAR CoMFA/CoMSIA models based on theoretical active conformers of HOE/BAY-793 analogs derived from HIV-1 protease inhibitor complexes
da Cunha, Elaine Fontes Ferreira, Sippl, Wolfgang, de Castro Ramalho, Teodorico, Ceva Antunes, Octavio Augusto, de Alencastro, Ricardo Bicca, Albuquerque, Magaly Girão
Published in European journal of medicinal chemistry (01.11.2009)
Published in European journal of medicinal chemistry (01.11.2009)
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Journal Article
Theoretical insights into the effect of halogenated substituent on the electronic structure and spectroscopic properties of the favipiravir tautomeric forms and its implications for the treatment of COVID-19
Assis, Letícia Cristina, de Castro, Alexandre Alves, de Jesus, João Paulo Almirão, da Cunha, Elaine Fontes Ferreira, Nepovimova, Eugenie, Krejcar, Ondrej, Kuca, Kamil, Ramalho, Teodorico Castro, La Porta, Felipe de Almeida
Published in RSC advances (01.11.2021)
Published in RSC advances (01.11.2021)
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Journal Article
QSAR Models Guided by Molecular Dynamics Applied to Human Glucokinase Activators
de Assis, Tamiris Maria, Gajo, Giovanna Cardoso, de Assis, Letícia Cristina, Garcia, Letícia Santos, Silva, Daniela Rodrigues, Ramalho, Teodorico Castro, da Cunha, Elaine Fontes Ferreira
Published in Chemical biology & drug design (01.03.2016)
Published in Chemical biology & drug design (01.03.2016)
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Journal Article
Docking studies and effects of syn-anti isomery of oximes derived from pyridine imidazol bicycled systems as potential human acetylcholinesterase reactivators
Guimarães, Ana Paula, França, Tanos Celmar Costa, Ramalho, Teodorico Castro, Rennó, Magdalena Nascimento, da Cunha, Elaine Fontes Ferreira, Matos, Karina Silvia, Mancini, Daiana Teixeira, Kuča, Kamil
Published in Journal of applied biomedicine (01.01.2011)
Published in Journal of applied biomedicine (01.01.2011)
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Journal Article
Coumarin/β-Cyclodextrin Inclusion Complexes Promote Acceleration and Improvement of Wound Healing
Dutra, Flávia Viana Avelar, Francisco, Carla Santana, Carneiro Pires, Bruna, Borges, Marcella Matos Cordeiro, Torres, Ana Luiza Horta, Resende, Vivian Alexandra, Mateus, Marcella Fernandes Mano, Cipriano, Daniel Fernandes, Miguez, Flávio Bastos, Freitas, Jair Carlos Checon de, Teixeira, Jéssika Poliana, Borges, Warley de Souza, Guimarães, Luciana, da Cunha, Elaine Fontes Ferreira, Ramalho, Teodorico de Castro, Nascimento, Clebio Soares, De Sousa, Frederico Barros, Costa, Raquel Alves, Lacerda, Valdemar, Borges, Keyller Bastos
Published in ACS applied materials & interfaces (19.06.2024)
Published in ACS applied materials & interfaces (19.06.2024)
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Journal Article
Gallic and Vanillic Acids as Promising Succinate Dehydrogenase Inhibitors and Antigenotoxic Agents
Silva de Abreu, Tatiane, Braga, Mariana Aparecida, Trento, Marcus Vinicius Cardoso, Konig, Isaac Filipe Moreira, Machado, Gustavo Henrique Andrade, Ferreira da Cunha, Elaine Fontes, Marcussi, Silvana
Published in Revista brasileira de farmacognosia (01.12.2021)
Published in Revista brasileira de farmacognosia (01.12.2021)
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Journal Article
SAMTa--A new proposal for computational analysis of molecular dynamics/SAMTa--Uma nova proposta para analise computacional de dinamicas moleculares
Carvalho, Bernardo de Assis, Ramalho, Teodorico Castro, da Cunha, Elaine Fontes Ferreira, do Lago, Daniel Guimaraes
Published in Acta scientiarum. Technology (01.10.2010)
Published in Acta scientiarum. Technology (01.10.2010)
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Journal Article
SAMTa - Uma nova proposta para análise computacional de dinâmicas moleculares = SAMTa - A new proposal for computational analysis of molecular dynamics
Daniel Guimarães do Lago, Elaine Fontes Ferreira da Cunha, Teodorico Castro Ramalho, Bernardo de Assis Carvalho
Published in Acta scientiarum. Technology (01.10.2010)
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Published in Acta scientiarum. Technology (01.10.2010)
Journal Article