Evaluating QM/MM Free Energy Surfaces for Ranking Cysteine Protease Covalent Inhibitors
da Costa, Clauber H. S, Bonatto, Vinícius, dos Santos, Alberto M, Lameira, Jerônimo, Leitão, Andrei, Montanari, Carlos A
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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Assessment of the PETase conformational changes induced by poly(ethylene terephthalate) binding
Costa, Clauber Henrique Souza, Santos, Alberto M., Alves, Cláudio Nahum, Martí, Sérgio, Moliner, Vicent, Santana, Kauê, Lameira, Jerônimo
Published in Proteins, structure, function, and bioinformatics (01.10.2021)
Published in Proteins, structure, function, and bioinformatics (01.10.2021)
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Thermostability Enhancement of GH 62 α‑l‑Arabinofuranosidase by Directed Evolution and Rational Design
Martins, Manoela, dos Santos, Alberto M., da Costa, Clauber H. S., Canner, Samuel W., Chungyoun, Michael, Gray, Jeffrey J., Skaf, Munir S., Ostermeier, Marc, Goldbeck, Rosana
Published in Journal of agricultural and food chemistry (28.02.2024)
Published in Journal of agricultural and food chemistry (28.02.2024)
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Assessment of Reversibility for Covalent Cysteine Protease Inhibitors Using Quantum Mechanics/Molecular Mechanics Free Energy Surfaces
Dos Santos, Alberto M., Oliveira, Amanda Ruslana Santana, da Costa, Clauber H. S., Kenny, Peter W., Montanari, Carlos A., Varela, Jaldyr de Jesus G., Lameira, Jerônimo
Published in Journal of chemical information and modeling (12.09.2022)
Published in Journal of chemical information and modeling (12.09.2022)
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Anti-Leishmania activity and molecular docking of unusual flavonoids-rich fraction from Arrabidaea brachypoda (Bignoniaceae)
das Neves, Monica A., do Nascimento, Jessyane R., Maciel-Silva, Vera Lucia, dos Santos, Alberto M., Junior, Jaldyr de Jesus G.V., Coelho, Ana Jessica S., Lima, Mayara Ingrid S., Pereira, Silma Regina F., da Rocha, Cláudia Q.
Published in Molecular and biochemical parasitology (01.09.2024)
Published in Molecular and biochemical parasitology (01.09.2024)
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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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Improvement on the melt-texturing performance of a (Y,Ta)0.5BaO3–YBa2Cu3Oy composite with superconductor applications
Bortolozo, Ausdinir D., Osório, Wislei R., Oliveira, Célio J.V., dos Santos, Carlos Alberto M., Filho, Francisco Moura, Machado, Antonio Jefferson S.
Published in Ceramics international (2015)
Published in Ceramics international (2015)
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