Metabolic Processing of Selenium-Based Bioisosteres of meso-Diaminopimelic Acid in Live Bacteria
Apostolos, Alexis J., Ocius, Karl L., Koyasseril-Yehiya, Thameez M., Santamaria, Carolina, Silva, José Rogério A., Lameira, Jerônimo, Alves, Cláudio N., Siegrist, M. Sloan, Pires, Marcos M.
Published in Biochemistry (Easton) (05.07.2022)
Published in Biochemistry (Easton) (05.07.2022)
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Computational study of conformational changes in human 3-hydroxy-3-methylglutaryl coenzyme reductase induced by substrate binding
Costa, Clauber Henrique Souza, Oliveira, Amanda Ruslana Santana, dos Santos, Alberto M., da Costa, Kauê Santana, Lima, Anderson Henrique Lima e, Alves, Cláudio N., Lameira, Jerônimo
Published in Journal of biomolecular structure & dynamics (02.11.2019)
Published in Journal of biomolecular structure & dynamics (02.11.2019)
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Journal Article
Facile Synthesis and Metabolic Incorporation of m‑DAP Bioisosteres Into Cell Walls of Live Bacteria
Apostolos, Alexis J, Nelson, Julia M, Silva, José Rogério A, Lameira, Jerônimo, Achimovich, Alecia M, Gahlmann, Andreas, Alves, Cláudio N, Pires, Marcos M
Published in ACS chemical biology (20.11.2020)
Published in ACS chemical biology (20.11.2020)
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Binding Free Energy Calculations of Nine FDA-approved Protease Inhibitors Against HIV-1 Subtype C I36T↑T Containing 100 Amino Acids Per Monomer
Lockhat, Husain A., Silva, José R. A., Alves, Cláudio N., Govender, Thavendran, Lameira, Jerônimo, Maguire, Glenn E. M., Sayed, Yasien, Kruger, Hendrik G.
Published in Chemical biology & drug design (01.04.2016)
Published in Chemical biology & drug design (01.04.2016)
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Journal Article
Application of Mangifera indica (mango) seeds as a biosorbent for removal of Victazol Orange 3R dye from aqueous solution and study of the biosorption mechanism
Alencar, Wagner S., Acayanka, Elie, Lima, Eder C., Royer, Betina, de Souza, Felipe E., Lameira, Jerônimo, Alves, Cláudio N.
Published in Chemical engineering journal (Lausanne, Switzerland : 1996) (15.10.2012)
Published in Chemical engineering journal (Lausanne, Switzerland : 1996) (15.10.2012)
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Calculation of binding energy using BLYP/MM for the HIV-1 integrase complexed with the S-1360 and two analogues
Alves, Cláudio N., Martí, Sergio, Castillo, Raquel, Andrés, Juan, Moliner, Vicent, Tuñón, Iñaki, Silla, Estanislao
Published in Bioorganic & medicinal chemistry (01.06.2007)
Published in Bioorganic & medicinal chemistry (01.06.2007)
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Molecular Modeling of T. rangeli, T. brucei gambiense, and T. evansi Sialidases in Complex with the DANA Inhibitor
Lima, Anderson H., Souza, Paulo R. M., Alencar, Nelson, Lameira, Jerônimo, Govender, Thavendran, Kruger, Hendrik G., Maguire, Glenn E. M., Alves, Cláudio N.
Published in Chemical biology & drug design (01.07.2012)
Published in Chemical biology & drug design (01.07.2012)
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Structure modeling of a metalloendopeptidase from Corynebacterium pseudotuberculosis
Guimarães, Luis C, Silva, Natália F, Miyoshi, Anderson, Schneider, Maria P.C, Silva, Artur, Azevedo, Vasco, Brasil, Davi S.B, Lameira, Jerônimo, Alves, Cláudio N
Published in Computers in biology and medicine (01.05.2012)
Published in Computers in biology and medicine (01.05.2012)
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Journal Article
Exploring Chloride Selectivity and Halogenase Regioselectivity of the SalL Enzyme through Quantum Mechanical/Molecular Mechanical Modeling
Pereira, Paulo R. M, Araújo, Jéssica de O, Silva, José Rogério A, Alves, Cláudio N, Lameira, Jerônimo, Lima, Anderson H
Published in Journal of chemical information and modeling (24.02.2020)
Published in Journal of chemical information and modeling (24.02.2020)
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Journal Article
Combined Kinetic Studies and Computational Analysis on Kojic Acid Analogs as Tyrosinase Inhibitors
Lima, Carlyle, Silva, José, de Tássia Carvalho Cardoso, Érica, Silva, Edilene, Lameira, Jerônimo, do Nascimento, José, do Socorro Barros Brasil, Davi, Alves, Cláudio
Published in Molecules (Basel, Switzerland) (01.07.2014)
Published in Molecules (Basel, Switzerland) (01.07.2014)
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Structure and analgesic properties of layered double hydroxides intercalated with low amounts of ibuprofen
Sousa, Robson, Jouin, Jenny, Masson, Olivier, Remondiere, Fabien, Lemarchand, Alex, Colas, Maggy, Thomas, Philippe, Lameira, Jerônimo, Bastos, Gilmara N. T., Lima, Anderson B., Nascimento, José L. M., Anicete‐Santos, Marcos, Monteiro, Waldinei R., Alves, Cláudio N.
Published in Journal of the American Ceramic Society (01.06.2017)
Published in Journal of the American Ceramic Society (01.06.2017)
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Antifungal activity and computational study of constituents from Piper divaricatum essential oil against Fusarium infection in black pepper
da Silva, Joyce Kelly R, Silva, José Rogério A, Nascimento, Soelange B, da Luz, Shirlley F M, Meireles, Erisléia N, Alves, Cláudio N, Ramos, Alessandra R, Maia, José Guilherme S
Published in Molecules (Basel, Switzerland) (01.11.2014)
Published in Molecules (Basel, Switzerland) (01.11.2014)
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Journal Article
A Quantum Mechanics/Molecular Mechanics Study of the Protein-Ligand Interaction for Inhibitors of HIV-1 Integrase
Alves, Cláudio N., Martí, Sergio, Castillo, Raquel, Andrés, Juan, Moliner, Vicent, Tuñón, Iñaki, Silla, Estanislao
Published in Chemistry : a European journal (01.01.2007)
Published in Chemistry : a European journal (01.01.2007)
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Journal Article
Investigation of conventional and non-conventional hydrogen bonds: a comparison of fluorine-substituted and non-fluorine substituted compounds
Alapour, Saba, Farahani, Majid D., Silva, José Rogério A., Alves, Cláudio N., Friedrich, Holger B., Ramjugernath, Deresh, Koorbanally, Neil A.
Published in Monatshefte für Chemie (01.12.2017)
Published in Monatshefte für Chemie (01.12.2017)
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Targeting the cell wall of Mycobacterium tuberculosis: a molecular modeling investigation of the interaction of imipenem and meropenem with L,D-transpeptidase 2
Silva, José Rogério A., Bishai, William R., Govender, Thavendran, Lamichhane, Gyanu, Maguire, Glenn E.M., Kruger, Hendrik G., Lameira, Jeronimo, Alves, Cláudio N.
Published in Journal of biomolecular structure & dynamics (01.01.2016)
Published in Journal of biomolecular structure & dynamics (01.01.2016)
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Journal Article
Structure of dihydrochalcones and related derivatives and their scavenging and antioxidant activity against oxygen and nitrogen radical species
Bentes, Alexandre L A, Borges, Rosivaldo S, Monteiro, Waldinei R, de Macedo, Luiz G M, Alves, Cláudio N
Published in Molecules (Basel, Switzerland) (21.02.2011)
Published in Molecules (Basel, Switzerland) (21.02.2011)
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Journal Article
Modelling Seagrass Biomass and Relative Nutrient Content
Kenov, Isabella Ascione, Deus, Ricardo, Alves, Cláudio N., Neves, Ramiro
Published in Journal of coastal research (01.11.2013)
Published in Journal of coastal research (01.11.2013)
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Journal Article
A theoretical study of phenolic compounds with antioxidant properties
Reis, Mauro, Lobato, Benedito, Lameira, Jeronimo, Santos, Alberdan S., Alves, Cláudio N.
Published in European journal of medicinal chemistry (01.04.2007)
Published in European journal of medicinal chemistry (01.04.2007)
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Journal Article
Inhibition of tyrosinase by 4H‐chromene analogs: Synthesis, kinetic studies, and computational analysis
Brasil, Edikarlos M., Canavieira, Luciana M., Cardoso, Érica T. C., Silva, Edilene O., Lameira, Jerônimo, Nascimento, José L. M., Eifler‐Lima, Vera L., Macchi, Barbarella M., Sriram, Dharmarajan, Bernhardt, Paul V., Silva, José Rogério Araújo, Williams, Craig M., Alves, Cláudio N.
Published in Chemical biology & drug design (01.11.2017)
Published in Chemical biology & drug design (01.11.2017)
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