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Artigo de periodico
Antioxidant capacity of simplified oxygen heterocycles and proposed derivatives by theoretical calculations (2023)
Borges, Rosivaldo S; Aguiar, Christiane p; Oliveira, Nicole l; Amaral, Israel N A; Vale, Joyce K. L; Cheves Neto, Antonio M J; Queiroz, Aureikson N; Silva, Alberico Borges Ferreira da
Source: Journal of Molecular Modeling. Unidade: IQSC
Subjects: FLAVONOIDES, POLIFENÓIS
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ABNT
BORGES, Rosivaldo S et al. Antioxidant capacity of simplified oxygen heterocycles and proposed derivatives by theoretical calculations. Journal of Molecular Modeling, v. 29, p. 232, 2023Tradução . . Disponível em: https://doi.org/10.1007/s00894-023-05602-8. Acesso em: 25 maio 2024.
APA
Borges, R. S., Aguiar, C. p, Oliveira, N. l, Amaral, I. N. A., Vale, J. K. L., Cheves Neto, A. M. J., et al. (2023). Antioxidant capacity of simplified oxygen heterocycles and proposed derivatives by theoretical calculations. Journal of Molecular Modeling, 29, 232. doi:10.1007/s00894-023-05602-8
NLM
Borges RS, Aguiar C p, Oliveira N l, Amaral INA, Vale JKL, Cheves Neto AMJ, Queiroz AN, Silva ABF da. Antioxidant capacity of simplified oxygen heterocycles and proposed derivatives by theoretical calculations [Internet]. Journal of Molecular Modeling. 2023 ;29 232.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00894-023-05602-8
Vancouver
Borges RS, Aguiar C p, Oliveira N l, Amaral INA, Vale JKL, Cheves Neto AMJ, Queiroz AN, Silva ABF da. Antioxidant capacity of simplified oxygen heterocycles and proposed derivatives by theoretical calculations [Internet]. Journal of Molecular Modeling. 2023 ;29 232.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00894-023-05602-8
Artigo de periodico
Diffusion Monte Carlo investigation of electronic structure properties for 13-atom alkali metal clusters (2023)
Angelotti, Wagner F.D.; Haiduke, Roberto Luiz Andrade ; Silva, Alberico Borges Ferreira da
Source: Chemical Physics. Unidade: IQSC
Subjects: METAIS ALCALINOS, QUÍMICA TEÓRICA
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ABNT
ANGELOTTI, Wagner F.D. e HAIDUKE, Roberto Luiz Andrade e SILVA, Alberico Borges Ferreira da. Diffusion Monte Carlo investigation of electronic structure properties for 13-atom alkali metal clusters. Chemical Physics, v. 565, p. 111767, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.chemphys.2022.111767. Acesso em: 25 maio 2024.
APA
Angelotti, W. F. D., Haiduke, R. L. A., & Silva, A. B. F. da. (2023). Diffusion Monte Carlo investigation of electronic structure properties for 13-atom alkali metal clusters. Chemical Physics, 565, 111767. doi:10.1016/j.chemphys.2022.111767
NLM
Angelotti WFD, Haiduke RLA, Silva ABF da. Diffusion Monte Carlo investigation of electronic structure properties for 13-atom alkali metal clusters [Internet]. Chemical Physics. 2023 ;565 111767.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.chemphys.2022.111767
Vancouver
Angelotti WFD, Haiduke RLA, Silva ABF da. Diffusion Monte Carlo investigation of electronic structure properties for 13-atom alkali metal clusters [Internet]. Chemical Physics. 2023 ;565 111767.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.chemphys.2022.111767
Artigo de periodico
Effect of pH on the synthesis of BiVO4 to improve photocatalysis and antimicrobial properties (2023)
Rodrigues, Murillo Henrique de Matos; Borges, Kellen Cristina Mesquita; Tello, Ana Cristina Mora ; Roca, Roman Alvarez; Gonçalves, Rosana de Fátima; Silva, Alberico Borges Ferreira da ; Longo, Elson; Godinho, Mario Junior
Source: Materials Chemistry and Physics. Unidade: IQSC
Subjects: BISMUTO, ZIRCÔNIA, FOTOCATÁLISE
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ABNT
RODRIGUES, Murillo Henrique de Matos et al. Effect of pH on the synthesis of BiVO4 to improve photocatalysis and antimicrobial properties. Materials Chemistry and Physics, v. 296, p. 127198, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.matchemphys.2022.127198. Acesso em: 25 maio 2024.
APA
Rodrigues, M. H. de M., Borges, K. C. M., Tello, A. C. M., Roca, R. A., Gonçalves, R. de F., Silva, A. B. F. da, et al. (2023). Effect of pH on the synthesis of BiVO4 to improve photocatalysis and antimicrobial properties. Materials Chemistry and Physics, 296, 127198. doi:10.1016/j.matchemphys.2022.127198
NLM
Rodrigues MH de M, Borges KCM, Tello ACM, Roca RA, Gonçalves R de F, Silva ABF da, Longo E, Godinho MJ. Effect of pH on the synthesis of BiVO4 to improve photocatalysis and antimicrobial properties [Internet]. Materials Chemistry and Physics. 2023 ;296 127198.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.matchemphys.2022.127198
Vancouver
Rodrigues MH de M, Borges KCM, Tello ACM, Roca RA, Gonçalves R de F, Silva ABF da, Longo E, Godinho MJ. Effect of pH on the synthesis of BiVO4 to improve photocatalysis and antimicrobial properties [Internet]. Materials Chemistry and Physics. 2023 ;296 127198.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.matchemphys.2022.127198
Artigo de periodico
A PLS study on the psychotropic activity for a series of cannabinoid compounds (2023)
Chiari, Laise Pellegrini Alencar ; Silva, Aldineia Pereira da ; Honorio, Kathia Maria ; Silva, Alberico Borges Ferreira da
Source: Journal of Molecular Modeling. Unidades: EACH, IQSC
Subjects: FÁRMACOS PSICOTRÓPICOS, CANABINOIDES, RECEPTORES, PROTEÍNAS, RELAÇÕES QUANTITATIVAS ENTRE ESTRUTURA QUÍMICA E ATIVIDADE BIOLÓGICA
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ABNT
CHIARI, Laise Pellegrini Alencar et al. A PLS study on the psychotropic activity for a series of cannabinoid compounds. Journal of Molecular Modeling, v. 29, 2023Tradução . . Disponível em: https://doi.org/10.1007/s00894-023-05443-5. Acesso em: 25 maio 2024.
APA
Chiari, L. P. A., Silva, A. P. da, Honorio, K. M., & Silva, A. B. F. da. (2023). A PLS study on the psychotropic activity for a series of cannabinoid compounds. Journal of Molecular Modeling, 29. doi:10.1007/s00894-023-05443-5
NLM
Chiari LPA, Silva AP da, Honorio KM, Silva ABF da. A PLS study on the psychotropic activity for a series of cannabinoid compounds [Internet]. Journal of Molecular Modeling. 2023 ; 29[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00894-023-05443-5
Vancouver
Chiari LPA, Silva AP da, Honorio KM, Silva ABF da. A PLS study on the psychotropic activity for a series of cannabinoid compounds [Internet]. Journal of Molecular Modeling. 2023 ; 29[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00894-023-05443-5
Artigo de periodico
Molecular structure of Ru(II)/diphosphine/4,6-dimethyl-2-pyrimidinethiol complexes: a combined experimental and density functional theory study (2023)
Lima, Benedicto Augusto Vieira ; Varela Junior, Jaldyr de Jesus Gomes ; Ellena, Javier ; Batista, Alzir Azevedo ; Silva, Alberico Borges Ferreira da ; Correa, Rodrigo de Souza
Source: Journal of Molecular Structure. Unidades: IFSC, IQSC
Subjects: RUTÊNIO, ESTRUTURA MOLECULAR (QUÍMICA TEÓRICA)
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ABNT
LIMA, Benedicto Augusto Vieira et al. Molecular structure of Ru(II)/diphosphine/4,6-dimethyl-2-pyrimidinethiol complexes: a combined experimental and density functional theory study. Journal of Molecular Structure, v. 1282, p. 135234-1-135234-12, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.molstruc.2023.135234. Acesso em: 25 maio 2024.
APA
Lima, B. A. V., Varela Junior, J. de J. G., Ellena, J., Batista, A. A., Silva, A. B. F. da, & Correa, R. de S. (2023). Molecular structure of Ru(II)/diphosphine/4,6-dimethyl-2-pyrimidinethiol complexes: a combined experimental and density functional theory study. Journal of Molecular Structure, 1282, 135234-1-135234-12. doi:10.1016/j.molstruc.2023.135234
NLM
Lima BAV, Varela Junior J de JG, Ellena J, Batista AA, Silva ABF da, Correa R de S. Molecular structure of Ru(II)/diphosphine/4,6-dimethyl-2-pyrimidinethiol complexes: a combined experimental and density functional theory study [Internet]. Journal of Molecular Structure. 2023 ; 1282 135234-1-135234-12.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.molstruc.2023.135234
Vancouver
Lima BAV, Varela Junior J de JG, Ellena J, Batista AA, Silva ABF da, Correa R de S. Molecular structure of Ru(II)/diphosphine/4,6-dimethyl-2-pyrimidinethiol complexes: a combined experimental and density functional theory study [Internet]. Journal of Molecular Structure. 2023 ; 1282 135234-1-135234-12.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.molstruc.2023.135234
Artigo de periodico
Estudo teórico e experimental de estrutura e reatividade relacionado ao metabolismo e toxicidade do paracetamol (2022)
Borges, Rosivaldo S.; Costa, Wanda S.; Gurrão, Ellen P. C.; Holanda, Luiz H. C.; Sousa, Alanna C. L. F.; Vale, Joyce K. L.; Alves, Cláudio N.; Silva, Alberico Borges Ferreira da
Source: Química Nova. Unidade: IQSC
Subjects: PARACETAMOL, METABOLISMO, TOXICOLOGIA
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ABNT
BORGES, Rosivaldo S. et al. Estudo teórico e experimental de estrutura e reatividade relacionado ao metabolismo e toxicidade do paracetamol. Química Nova, v. 45, n. 9, p. 1160-1166, 2022Tradução . . Disponível em: https://doi.org/10.21577/0100-4042.20170927. Acesso em: 25 maio 2024.
APA
Borges, R. S., Costa, W. S., Gurrão, E. P. C., Holanda, L. H. C., Sousa, A. C. L. F., Vale, J. K. L., et al. (2022). Estudo teórico e experimental de estrutura e reatividade relacionado ao metabolismo e toxicidade do paracetamol. Química Nova, 45( 9), 1160-1166. doi:10.21577/0100-4042.20170927
NLM
Borges RS, Costa WS, Gurrão EPC, Holanda LHC, Sousa ACLF, Vale JKL, Alves CN, Silva ABF da. Estudo teórico e experimental de estrutura e reatividade relacionado ao metabolismo e toxicidade do paracetamol [Internet]. Química Nova. 2022 ;45( 9): 1160-1166.[citado 2024 maio 25 ] Available from: https://doi.org/10.21577/0100-4042.20170927
Vancouver
Borges RS, Costa WS, Gurrão EPC, Holanda LHC, Sousa ACLF, Vale JKL, Alves CN, Silva ABF da. Estudo teórico e experimental de estrutura e reatividade relacionado ao metabolismo e toxicidade do paracetamol [Internet]. Química Nova. 2022 ;45( 9): 1160-1166.[citado 2024 maio 25 ] Available from: https://doi.org/10.21577/0100-4042.20170927
Artigo de periodico
One-dimensional confined bose gas in a quartic potential: calculation of the energy levels and the critical coupling parameter (2022)
Sousa, Alexsandro Gama de; Bagnato, Vanderlei Salvador ; Silva, Alberico Borges Ferreira da ; Tello, Ana Cristina Mora ; Nascimento, Valter Aragão do
Source: Journal of Physics and Optics Sciences. Unidades: IFSC, IQSC
Subjects: CONDENSADO DE BOSE-EINSTEIN, GASES, ENERGIA
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ABNT
SOUSA, Alexsandro Gama de et al. One-dimensional confined bose gas in a quartic potential: calculation of the energy levels and the critical coupling parameter. Journal of Physics and Optics Sciences, v. 4, n. 5, p. 1-6, 2022Tradução . . Disponível em: https://doi.org/10.47363/JPSOS/2022(4)172. Acesso em: 25 maio 2024.
APA
Sousa, A. G. de, Bagnato, V. S., Silva, A. B. F. da, Tello, A. C. M., & Nascimento, V. A. do. (2022). One-dimensional confined bose gas in a quartic potential: calculation of the energy levels and the critical coupling parameter. Journal of Physics and Optics Sciences, 4( 5), 1-6. doi:10.47363/JPSOS/2022(4)172
NLM
Sousa AG de, Bagnato VS, Silva ABF da, Tello ACM, Nascimento VA do. One-dimensional confined bose gas in a quartic potential: calculation of the energy levels and the critical coupling parameter [Internet]. Journal of Physics and Optics Sciences. 2022 ; 4( 5): 1-6.[citado 2024 maio 25 ] Available from: https://doi.org/10.47363/JPSOS/2022(4)172
Vancouver
Sousa AG de, Bagnato VS, Silva ABF da, Tello ACM, Nascimento VA do. One-dimensional confined bose gas in a quartic potential: calculation of the energy levels and the critical coupling parameter [Internet]. Journal of Physics and Optics Sciences. 2022 ; 4( 5): 1-6.[citado 2024 maio 25 ] Available from: https://doi.org/10.47363/JPSOS/2022(4)172
Artigo de periodico
A mechanistic view of the reaction between phosphine and fluorine atom: Insights into PH3F isomers (2022)
Viana, Rommel Bezerra ; Savedra, Ranylson M. L ; Silva, Alberico Borges Ferreira da
Source: Computational and Theoretical Chemistry. Unidade: IQSC
Subjects: TERMODINÂMICA (FÍSICO-QUÍMICA), ISÔMERO
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ABNT
VIANA, Rommel Bezerra e SAVEDRA, Ranylson M. L e SILVA, Alberico Borges Ferreira da. A mechanistic view of the reaction between phosphine and fluorine atom: Insights into PH3F isomers. Computational and Theoretical Chemistry, v. 1214, 2022Tradução . . Disponível em: https://doi.org/10.1016/j.comptc.2022.113769. Acesso em: 25 maio 2024.
APA
Viana, R. B., Savedra, R. M. L., & Silva, A. B. F. da. (2022). A mechanistic view of the reaction between phosphine and fluorine atom: Insights into PH3F isomers. Computational and Theoretical Chemistry, 1214. doi:10.1016/j.comptc.2022.113769
NLM
Viana RB, Savedra RML, Silva ABF da. A mechanistic view of the reaction between phosphine and fluorine atom: Insights into PH3F isomers [Internet]. Computational and Theoretical Chemistry. 2022 ; 1214[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.comptc.2022.113769
Vancouver
Viana RB, Savedra RML, Silva ABF da. A mechanistic view of the reaction between phosphine and fluorine atom: Insights into PH3F isomers [Internet]. Computational and Theoretical Chemistry. 2022 ; 1214[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.comptc.2022.113769
Artigo de periodico
Examining the effect of charged lipids on mitochondrial outer membrane dynamics using atomistic simulations (2022)
Oliveira, Aline A ; Róg, Tomasz ; Silva, Alberico Borges Ferreira da ; Amaro, Rommie E.; Johnson, Mark S. ; Postila, Pekka A.
Source: Biomolecules. Unidade: IQSC
Subjects: BIOQUÍMICA, BIOLOGIA MOLECULAR, ESQUIZOFRENIA
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ABNT
OLIVEIRA, Aline A et al. Examining the effect of charged lipids on mitochondrial outer membrane dynamics using atomistic simulations. Biomolecules, v. 12, n. 2, p. 183-197, 2022Tradução . . Disponível em: https://doi.org/10.3390/biom12020183. Acesso em: 25 maio 2024.
APA
Oliveira, A. A., Róg, T., Silva, A. B. F. da, Amaro, R. E., Johnson, M. S., & Postila, P. A. (2022). Examining the effect of charged lipids on mitochondrial outer membrane dynamics using atomistic simulations. Biomolecules, 12( 2), 183-197. doi:10.3390/biom12020183
NLM
Oliveira AA, Róg T, Silva ABF da, Amaro RE, Johnson MS, Postila PA. Examining the effect of charged lipids on mitochondrial outer membrane dynamics using atomistic simulations [Internet]. Biomolecules. 2022 ; 12( 2): 183-197.[citado 2024 maio 25 ] Available from: https://doi.org/10.3390/biom12020183
Vancouver
Oliveira AA, Róg T, Silva ABF da, Amaro RE, Johnson MS, Postila PA. Examining the effect of charged lipids on mitochondrial outer membrane dynamics using atomistic simulations [Internet]. Biomolecules. 2022 ; 12( 2): 183-197.[citado 2024 maio 25 ] Available from: https://doi.org/10.3390/biom12020183
Artigo de periodico
Bridging experiment and theory: morphology, optical, electronic, and magnetic properties of MnWO4 (2022)
Assis, Marcelo; Tello, Ana Cristina Mora ; Abud, Fábio Santos Alves ; Negre, Pablo; Ribeiro, Lara K. ; Ribeiro, Renan A. P. ; Masunaga, Sueli H ; Lima, Aline E.B. ; Luz Jr, Geraldo E. ; Jardim, Renato de Figueiredo ; Silva, Alberico Borges Ferreira da ; Andres, Juan ; Longo, Elson
Source: Applied Surface Science. Unidades: IF, IQSC
Assunto: QUÍMICA QUÂNTICA
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ABNT
ASSIS, Marcelo et al. Bridging experiment and theory: morphology, optical, electronic, and magnetic properties of MnWO4. Applied Surface Science, v. 600, p. 154081, 2022Tradução . . Disponível em: https://doi.org/10.1016/j.apsusc.2022.154081. Acesso em: 25 maio 2024.
APA
Assis, M., Tello, A. C. M., Abud, F. S. A., Negre, P., Ribeiro, L. K., Ribeiro, R. A. P., et al. (2022). Bridging experiment and theory: morphology, optical, electronic, and magnetic properties of MnWO4. Applied Surface Science, 600, 154081. doi:10.1016/j.apsusc.2022.154081
NLM
Assis M, Tello ACM, Abud FSA, Negre P, Ribeiro LK, Ribeiro RAP, Masunaga SH, Lima AEB, Luz Jr GE, Jardim R de F, Silva ABF da, Andres J, Longo E. Bridging experiment and theory: morphology, optical, electronic, and magnetic properties of MnWO4 [Internet]. Applied Surface Science. 2022 ; 600 154081.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.apsusc.2022.154081
Vancouver
Assis M, Tello ACM, Abud FSA, Negre P, Ribeiro LK, Ribeiro RAP, Masunaga SH, Lima AEB, Luz Jr GE, Jardim R de F, Silva ABF da, Andres J, Longo E. Bridging experiment and theory: morphology, optical, electronic, and magnetic properties of MnWO4 [Internet]. Applied Surface Science. 2022 ; 600 154081.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.apsusc.2022.154081
Artigo de periodico
A Theoretical Antioxidant Mechanism for Cytoprotective Effect of p-AcetamideSalicylate Derivatives against Free Radical Initiator AAPH in Human Erythrocytes (2021)
Barros, Valéria A.; Pereira, Glaécia A. N.; Ota, Sirlene S. B.; Melo, Fernanda P. A.; Jesus, Ana Carolina S. P. S. de; Lima, Anderson B.; Silva, Alberico Borges Ferreira da ; Borges, Rosivaldo S.
Source: Journal of Brazilian Chemical Society. Unidade: IQSC
Subjects: RADICAIS LIVRES, ERITRÓCITOS, ANTIOXIDANTES
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ABNT
BARROS, Valéria A. et al. A Theoretical Antioxidant Mechanism for Cytoprotective Effect of p-AcetamideSalicylate Derivatives against Free Radical Initiator AAPH in Human Erythrocytes. Journal of Brazilian Chemical Society, v. 32, n. 7, p. 1354-1360, 2021Tradução . . Disponível em: https://doi.org/10.21577/0103-5053.20210033. Acesso em: 25 maio 2024.
APA
Barros, V. A., Pereira, G. A. N., Ota, S. S. B., Melo, F. P. A., Jesus, A. C. S. P. S. de, Lima, A. B., et al. (2021). A Theoretical Antioxidant Mechanism for Cytoprotective Effect of p-AcetamideSalicylate Derivatives against Free Radical Initiator AAPH in Human Erythrocytes. Journal of Brazilian Chemical Society, 32( 7), 1354-1360. doi:10.21577/0103-5053.20210033
NLM
Barros VA, Pereira GAN, Ota SSB, Melo FPA, Jesus ACSPS de, Lima AB, Silva ABF da, Borges RS. A Theoretical Antioxidant Mechanism for Cytoprotective Effect of p-AcetamideSalicylate Derivatives against Free Radical Initiator AAPH in Human Erythrocytes [Internet]. Journal of Brazilian Chemical Society. 2021 ; 32( 7): 1354-1360.[citado 2024 maio 25 ] Available from: https://doi.org/10.21577/0103-5053.20210033
Vancouver
Barros VA, Pereira GAN, Ota SSB, Melo FPA, Jesus ACSPS de, Lima AB, Silva ABF da, Borges RS. A Theoretical Antioxidant Mechanism for Cytoprotective Effect of p-AcetamideSalicylate Derivatives against Free Radical Initiator AAPH in Human Erythrocytes [Internet]. Journal of Brazilian Chemical Society. 2021 ; 32( 7): 1354-1360.[citado 2024 maio 25 ] Available from: https://doi.org/10.21577/0103-5053.20210033
Artigo de periodico
New D2R partial agonist candidates:: an in silico approach from statistical models, molecular docking, and ADME/Tox propertie (2021)
Silva, Aldineia Pereira da ; Chiari, Laise Pellegrini Alencar ; Guimaraes, Amanda Ribeiro ; Honório, Káthia Maria ; Silva, Alberico Borges Ferreira da
Source: Structural Chemistry. Unidades: EACH, IQSC
Subjects: ESQUIZOFRENIA, QUÍMICA
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ABNT
SILVA, Aldineia Pereira da et al. New D2R partial agonist candidates:: an in silico approach from statistical models, molecular docking, and ADME/Tox propertie. Structural Chemistry, v. 32, p. 2019–2033, 2021Tradução . . Disponível em: https://doi.org/10.1007/s11224-021-01742-w. Acesso em: 25 maio 2024.
APA
Silva, A. P. da, Chiari, L. P. A., Guimaraes, A. R., Honório, K. M., & Silva, A. B. F. da. (2021). New D2R partial agonist candidates:: an in silico approach from statistical models, molecular docking, and ADME/Tox propertie. Structural Chemistry, 32, 2019–2033. doi:10.1007/s11224-021-01742-w
NLM
Silva AP da, Chiari LPA, Guimaraes AR, Honório KM, Silva ABF da. New D2R partial agonist candidates:: an in silico approach from statistical models, molecular docking, and ADME/Tox propertie [Internet]. Structural Chemistry. 2021 ; 32 2019–2033.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s11224-021-01742-w
Vancouver
Silva AP da, Chiari LPA, Guimaraes AR, Honório KM, Silva ABF da. New D2R partial agonist candidates:: an in silico approach from statistical models, molecular docking, and ADME/Tox propertie [Internet]. Structural Chemistry. 2021 ; 32 2019–2033.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s11224-021-01742-w
Artigo de periodico
A partial least squares and artifcial neural network study for a series of arylpiperazines as antidepressant agents (2021)
Santos, Genisson R.; Chiari, Laise Pellegrini Alencar ; Silva, Aldineia P. da; Lipinski, Célio Fernando ; Oliveira, Aline A.; Honório, Káthia Maria ; Sousa, Alexsandro Gama de; Silva, Alberico Borges Ferreira da
Source: Journal of Molecular Modeling: computational chemistry - life science - advanced materials - new methods. Unidades: EACH, IQSC
Subjects: DEPRESSÃO, ANTIDEPRESSIVOS
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ABNT
SANTOS, Genisson R. et al. A partial least squares and artifcial neural network study for a series of arylpiperazines as antidepressant agents. Journal of Molecular Modeling: computational chemistry - life science - advanced materials - new methods, p. 297, 2021Tradução . . Disponível em: https://doi.org/10.1007/s00894-021-04906-x. Acesso em: 25 maio 2024.
APA
Santos, G. R., Chiari, L. P. A., Silva, A. P. da, Lipinski, C. F., Oliveira, A. A., Honório, K. M., et al. (2021). A partial least squares and artifcial neural network study for a series of arylpiperazines as antidepressant agents. Journal of Molecular Modeling: computational chemistry - life science - advanced materials - new methods, 297. doi:10.1007/s00894-021-04906-x
NLM
Santos GR, Chiari LPA, Silva AP da, Lipinski CF, Oliveira AA, Honório KM, Sousa AG de, Silva ABF da. A partial least squares and artifcial neural network study for a series of arylpiperazines as antidepressant agents [Internet]. Journal of Molecular Modeling: computational chemistry - life science - advanced materials - new methods. 2021 ;297.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00894-021-04906-x
Vancouver
Santos GR, Chiari LPA, Silva AP da, Lipinski CF, Oliveira AA, Honório KM, Sousa AG de, Silva ABF da. A partial least squares and artifcial neural network study for a series of arylpiperazines as antidepressant agents [Internet]. Journal of Molecular Modeling: computational chemistry - life science - advanced materials - new methods. 2021 ;297.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00894-021-04906-x
Artigo de periodico
Drug design of new sigma-1 antagonists against neuropathic pain: A QSAR study using partial least squares and artificial neural networks (2021)
Chiari, Laise Pellegrini Alencar; Silva, Aldineia Pereira da; Oliveira, Aline A; Lipinski, Célio Fernando ; Honório, Káthia Maria ; Silva, Alberico Borges Ferreira da
Source: Journal of Molecular Structure. Unidades: EACH, IQSC
Subjects: QUALIDADE DE VIDA, NEUROLOGIA
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ABNT
CHIARI, Laise Pellegrini Alencar et al. Drug design of new sigma-1 antagonists against neuropathic pain: A QSAR study using partial least squares and artificial neural networks. Journal of Molecular Structure, v. 1223, p. 129156, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.molstruc.2020.129156. Acesso em: 25 maio 2024.
APA
Chiari, L. P. A., Silva, A. P. da, Oliveira, A. A., Lipinski, C. F., Honório, K. M., & Silva, A. B. F. da. (2021). Drug design of new sigma-1 antagonists against neuropathic pain: A QSAR study using partial least squares and artificial neural networks. Journal of Molecular Structure, 1223, 129156. doi:10.1016/j.molstruc.2020.129156
NLM
Chiari LPA, Silva AP da, Oliveira AA, Lipinski CF, Honório KM, Silva ABF da. Drug design of new sigma-1 antagonists against neuropathic pain: A QSAR study using partial least squares and artificial neural networks [Internet]. Journal of Molecular Structure. 2021 ; 1223 129156.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.molstruc.2020.129156
Vancouver
Chiari LPA, Silva AP da, Oliveira AA, Lipinski CF, Honório KM, Silva ABF da. Drug design of new sigma-1 antagonists against neuropathic pain: A QSAR study using partial least squares and artificial neural networks [Internet]. Journal of Molecular Structure. 2021 ; 1223 129156.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.molstruc.2020.129156
Artigo de periodico
Drug design of new 5-HT6R antagonists aided by artificial neural networks (2021)
Silva, Aldineia Pereira da ; Chiari, Laise Pellegrini Alencar ; Guimaraes, Amanda Ribeiro ; Honório, Káthia Maria ; Silva, Alberico Borges Ferreira da
Source: Journal of Molecular Graphics and Modelling. Unidades: IQSC, EACH
Subjects: DOENÇA DE ALZHEIMER, HALOGÊNIOS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
SILVA, Aldineia Pereira da et al. Drug design of new 5-HT6R antagonists aided by artificial neural networks. Journal of Molecular Graphics and Modelling, v. 104, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.jmgm.2021.107844. Acesso em: 25 maio 2024.
APA
Silva, A. P. da, Chiari, L. P. A., Guimaraes, A. R., Honório, K. M., & Silva, A. B. F. da. (2021). Drug design of new 5-HT6R antagonists aided by artificial neural networks. Journal of Molecular Graphics and Modelling, 104. doi:10.1016/j.jmgm.2021.107844
NLM
Silva AP da, Chiari LPA, Guimaraes AR, Honório KM, Silva ABF da. Drug design of new 5-HT6R antagonists aided by artificial neural networks [Internet]. Journal of Molecular Graphics and Modelling. 2021 ; 104[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.jmgm.2021.107844
Vancouver
Silva AP da, Chiari LPA, Guimaraes AR, Honório KM, Silva ABF da. Drug design of new 5-HT6R antagonists aided by artificial neural networks [Internet]. Journal of Molecular Graphics and Modelling. 2021 ; 104[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.jmgm.2021.107844
Artigo de periodico
Generation, contraction, and polarisation of Gaussian basis sets for atomic and molecular calculations using the generator coordinate method with polynomial discretisation: atoms from Na through Cl (2021)
Guimaraes, Amanda Ribeiro ; Barbosa, Rugles C.; Tello, Ana Cristina Mora; Silva, Aldineia Pereira da ; Alves, Júlia M. A.; Maringolo, Milena Palhares; Silva, Alberico Borges Ferreira da
Source: Physical Chemistry Chemical Physics. Unidade: IQSC
Subjects: SÓDIO, CLORO
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
GUIMARAES, Amanda Ribeiro et al. Generation, contraction, and polarisation of Gaussian basis sets for atomic and molecular calculations using the generator coordinate method with polynomial discretisation: atoms from Na through Cl. Physical Chemistry Chemical Physics, v. 23, 2021Tradução . . Disponível em: https://doi.org/10.1039/d1cp01879e. Acesso em: 25 maio 2024.
APA
Guimaraes, A. R., Barbosa, R. C., Tello, A. C. M., Silva, A. P. da, Alves, J. M. A., Maringolo, M. P., & Silva, A. B. F. da. (2021). Generation, contraction, and polarisation of Gaussian basis sets for atomic and molecular calculations using the generator coordinate method with polynomial discretisation: atoms from Na through Cl. Physical Chemistry Chemical Physics, 23. doi:10.1039/d1cp01879e
NLM
Guimaraes AR, Barbosa RC, Tello ACM, Silva AP da, Alves JMA, Maringolo MP, Silva ABF da. Generation, contraction, and polarisation of Gaussian basis sets for atomic and molecular calculations using the generator coordinate method with polynomial discretisation: atoms from Na through Cl [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23[citado 2024 maio 25 ] Available from: https://doi.org/10.1039/d1cp01879e
Vancouver
Guimaraes AR, Barbosa RC, Tello ACM, Silva AP da, Alves JMA, Maringolo MP, Silva ABF da. Generation, contraction, and polarisation of Gaussian basis sets for atomic and molecular calculations using the generator coordinate method with polynomial discretisation: atoms from Na through Cl [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23[citado 2024 maio 25 ] Available from: https://doi.org/10.1039/d1cp01879e
Artigo de periodico
Determination of Tetracycline Using a Graphite- Polyurethane Composite Electrode Modified with a Molecularly Imprinted Polymer (2020)
Clarindo, João Paulo ; Viana, R. B; Cervini, Priscila ; Silva, Alberico Borges Ferreira da ; Cavalheiro, Eder Tadeu Gomes
Source: Analytical Letters. Unidade: IQSC
Subjects: ELETRODO, POLÍMEROS (MATERIAIS)
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
CLARINDO, João Paulo et al. Determination of Tetracycline Using a Graphite- Polyurethane Composite Electrode Modified with a Molecularly Imprinted Polymer. Analytical Letters, v. 53, n. 12, p. 1932-1955, 2020Tradução . . Disponível em: https://doi.org/10.1080/00032719.2020.1725540. Acesso em: 25 maio 2024.
APA
Clarindo, J. P., Viana, R. B., Cervini, P., Silva, A. B. F. da, & Cavalheiro, E. T. G. (2020). Determination of Tetracycline Using a Graphite- Polyurethane Composite Electrode Modified with a Molecularly Imprinted Polymer. Analytical Letters, 53( 12), 1932-1955. doi:10.1080/00032719.2020.1725540
NLM
Clarindo JP, Viana RB, Cervini P, Silva ABF da, Cavalheiro ETG. Determination of Tetracycline Using a Graphite- Polyurethane Composite Electrode Modified with a Molecularly Imprinted Polymer [Internet]. Analytical Letters. 2020 ; 53( 12): 1932-1955.[citado 2024 maio 25 ] Available from: https://doi.org/10.1080/00032719.2020.1725540
Vancouver
Clarindo JP, Viana RB, Cervini P, Silva ABF da, Cavalheiro ETG. Determination of Tetracycline Using a Graphite- Polyurethane Composite Electrode Modified with a Molecularly Imprinted Polymer [Internet]. Analytical Letters. 2020 ; 53( 12): 1932-1955.[citado 2024 maio 25 ] Available from: https://doi.org/10.1080/00032719.2020.1725540
Artigo de periodico
Microwave-Driven Hexagonal-to-Monoclinic Transition in BiPO4: An In-Depth Experimental Investigation and First-Principles Study (2020)
Tello, Ana Cristina Mora; Assis, Marcelo ; Menasce, Ricardo; Gouveia, Amanda F ; Teodoro, Vinicius; Jacomaci, Natalia ; Zaghete, Maria Aparecida ; Andres, Juan ; Marques, Gilmar Eugênio ; Teodoro, Marcio Daldin ; Silva, Alberico Borges Ferreira da ; Bettini, Jefferson ; Longo, Elson
Source: Inorganic Chemistry. Unidade: IQSC
Subjects: IRRADIAÇÃO, FOSFATOS, BISMUTO, QUÍMICA INORGÂNICA
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ABNT
TELLO, Ana Cristina Mora et al. Microwave-Driven Hexagonal-to-Monoclinic Transition in BiPO4: An In-Depth Experimental Investigation and First-Principles Study. Inorganic Chemistry, v. 59, n. 11, p. 7453–7468 May, 2020Tradução . . Disponível em: https://doi.org/10.1021/acs.inorgchem.0c00181. Acesso em: 25 maio 2024.
APA
Tello, A. C. M., Assis, M., Menasce, R., Gouveia, A. F., Teodoro, V., Jacomaci, N., et al. (2020). Microwave-Driven Hexagonal-to-Monoclinic Transition in BiPO4: An In-Depth Experimental Investigation and First-Principles Study. Inorganic Chemistry, 59( 11), 7453–7468 May. doi:10.1021/acs.inorgchem.0c00181
NLM
Tello ACM, Assis M, Menasce R, Gouveia AF, Teodoro V, Jacomaci N, Zaghete MA, Andres J, Marques GE, Teodoro MD, Silva ABF da, Bettini J, Longo E. Microwave-Driven Hexagonal-to-Monoclinic Transition in BiPO4: An In-Depth Experimental Investigation and First-Principles Study [Internet]. Inorganic Chemistry. 2020 ; 59( 11): 7453–7468 May.[citado 2024 maio 25 ] Available from: https://doi.org/10.1021/acs.inorgchem.0c00181
Vancouver
Tello ACM, Assis M, Menasce R, Gouveia AF, Teodoro V, Jacomaci N, Zaghete MA, Andres J, Marques GE, Teodoro MD, Silva ABF da, Bettini J, Longo E. Microwave-Driven Hexagonal-to-Monoclinic Transition in BiPO4: An In-Depth Experimental Investigation and First-Principles Study [Internet]. Inorganic Chemistry. 2020 ; 59( 11): 7453–7468 May.[citado 2024 maio 25 ] Available from: https://doi.org/10.1021/acs.inorgchem.0c00181
Artigo de periodico
Accurate atomic electron afnities calculated by using anionic Gaussian basis sets (2020)
Amaral, Rafael Costa; Tello, Ana Cristina Mora; Colmar Junior, Moacyr; Silva, Alberico Borges Ferreira da
Source: Theoretical Chemistry Accounts. Unidade: IQSC
Subjects: QUÍMICA TEÓRICA, ELÉTRONS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
AMARAL, Rafael Costa et al. Accurate atomic electron afnities calculated by using anionic Gaussian basis sets. Theoretical Chemistry Accounts, v. 139, p. 128, 2020Tradução . . Disponível em: https://doi.org/10.1007/s00214-020-02629-5. Acesso em: 25 maio 2024.
APA
Amaral, R. C., Tello, A. C. M., Colmar Junior, M., & Silva, A. B. F. da. (2020). Accurate atomic electron afnities calculated by using anionic Gaussian basis sets. Theoretical Chemistry Accounts, 139, 128. doi:10.1007/s00214-020-02629-5
NLM
Amaral RC, Tello ACM, Colmar Junior M, Silva ABF da. Accurate atomic electron afnities calculated by using anionic Gaussian basis sets [Internet]. Theoretical Chemistry Accounts. 2020 ; 139 128.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00214-020-02629-5
Vancouver
Amaral RC, Tello ACM, Colmar Junior M, Silva ABF da. Accurate atomic electron afnities calculated by using anionic Gaussian basis sets [Internet]. Theoretical Chemistry Accounts. 2020 ; 139 128.[citado 2024 maio 25 ] Available from: https://doi.org/10.1007/s00214-020-02629-5
Artigo de periodico
Experimental and theoretical study on structure-tautomerism among edaravone, isoxazolone, and their heterocycles derivatives as antioxidants (2020)
Queiroz, Aureikson N; Martins, Camila C.; Santos, Kelton Luis Belém dos ; Carvalho, Ederson S.; Owiti, Alex O.; Oliveira, Karen Renata Matos; Herculano, Anderson M.; Silva, Alberico Borges Ferreira da ; Borges, Rosivaldo S
Source: Saudi Pharmaceutical Journal. Unidade: IQSC
Assunto: ANTIOXIDANTES
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
QUEIROZ, Aureikson N et al. Experimental and theoretical study on structure-tautomerism among edaravone, isoxazolone, and their heterocycles derivatives as antioxidants. Saudi Pharmaceutical Journal, v. 28, n. 7, p. 819-827, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.jsps.2020.06.001. Acesso em: 25 maio 2024.
APA
Queiroz, A. N., Martins, C. C., Santos, K. L. B. dos, Carvalho, E. S., Owiti, A. O., Oliveira, K. R. M., et al. (2020). Experimental and theoretical study on structure-tautomerism among edaravone, isoxazolone, and their heterocycles derivatives as antioxidants. Saudi Pharmaceutical Journal, 28( 7), 819-827. doi:10.1016/j.jsps.2020.06.001
NLM
Queiroz AN, Martins CC, Santos KLB dos, Carvalho ES, Owiti AO, Oliveira KRM, Herculano AM, Silva ABF da, Borges RS. Experimental and theoretical study on structure-tautomerism among edaravone, isoxazolone, and their heterocycles derivatives as antioxidants [Internet]. Saudi Pharmaceutical Journal. 2020 ; 28( 7): 819-827.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.jsps.2020.06.001
Vancouver
Queiroz AN, Martins CC, Santos KLB dos, Carvalho ES, Owiti AO, Oliveira KRM, Herculano AM, Silva ABF da, Borges RS. Experimental and theoretical study on structure-tautomerism among edaravone, isoxazolone, and their heterocycles derivatives as antioxidants [Internet]. Saudi Pharmaceutical Journal. 2020 ; 28( 7): 819-827.[citado 2024 maio 25 ] Available from: https://doi.org/10.1016/j.jsps.2020.06.001

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