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Artigo de periodico
Andrographolide: a diterpenoid from cymbopogon schoenanthus identified as a new hit compound against trypanosoma cruzi using machine learning and experimental approaches (2024)
Barbosa, Henrique ; Espinoza, Gabriel Zarzana; Amaral, Maiara; Levatti, Erica Valadares de Castro ; Abiuzi, Mariana Babberg ; Veríssimo, Gabriel Corrêa ; Fernandes, Philipe Oliveira ; Maltarollo, Vinícius Gonçalves ; Tempone, Andre Gustavo ; Honorio, Kathia Maria ; Lago, João Henrique Ghilardi
Source: Journal of Chemical Information and Modeling. Unidade: EACH
Assunto: DOENÇA DE CHAGAS
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BARBOSA, Henrique et al. Andrographolide: a diterpenoid from cymbopogon schoenanthus identified as a new hit compound against trypanosoma cruzi using machine learning and experimental approaches. Journal of Chemical Information and Modeling, v. 64, p. 2565−2576, 2024Tradução . . Disponível em: http://dx.doi.org/10.1021/acs.jcim.3c01410. Acesso em: 04 nov. 2024.
APA
Barbosa, H., Espinoza, G. Z., Amaral, M., Levatti, E. V. de C., Abiuzi, M. B., Veríssimo, G. C., et al. (2024). Andrographolide: a diterpenoid from cymbopogon schoenanthus identified as a new hit compound against trypanosoma cruzi using machine learning and experimental approaches. Journal of Chemical Information and Modeling, 64, 2565−2576. doi:10.1021/acs.jcim.3c01410
NLM
Barbosa H, Espinoza GZ, Amaral M, Levatti EV de C, Abiuzi MB, Veríssimo GC, Fernandes PO, Maltarollo VG, Tempone AG, Honorio KM, Lago JHG. Andrographolide: a diterpenoid from cymbopogon schoenanthus identified as a new hit compound against trypanosoma cruzi using machine learning and experimental approaches [Internet]. Journal of Chemical Information and Modeling. 2024 ; 64 2565−2576.[citado 2024 nov. 04 ] Available from: http://dx.doi.org/10.1021/acs.jcim.3c01410
Vancouver
Barbosa H, Espinoza GZ, Amaral M, Levatti EV de C, Abiuzi MB, Veríssimo GC, Fernandes PO, Maltarollo VG, Tempone AG, Honorio KM, Lago JHG. Andrographolide: a diterpenoid from cymbopogon schoenanthus identified as a new hit compound against trypanosoma cruzi using machine learning and experimental approaches [Internet]. Journal of Chemical Information and Modeling. 2024 ; 64 2565−2576.[citado 2024 nov. 04 ] Available from: http://dx.doi.org/10.1021/acs.jcim.3c01410
Artigo de periodico
A study of possible substitutes for the endocrine disruptor DEHP in two hormone receptors (2022)
Almeida, Michell de Oliveira ; Lanza, Marcos Roberto de Vasconcelos ; Honório, Káthia Maria
Source: Journal of Biomolecular Structure and Dynamics. Unidades: IQSC, EACH
Subjects: POLUIÇÃO AMBIENTAL, RECEPTORES HORMONAIS
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ALMEIDA, Michell de Oliveira e LANZA, Marcos Roberto de Vasconcelos e HONÓRIO, Káthia Maria. A study of possible substitutes for the endocrine disruptor DEHP in two hormone receptors. Journal of Biomolecular Structure and Dynamics, v. 40, n. 23, p. 12516–12525, 2022Tradução . . Disponível em: https://doi.org/10.1080/07391102.2021.1971566. Acesso em: 04 nov. 2024.
APA
Almeida, M. de O., Lanza, M. R. de V., & Honório, K. M. (2022). A study of possible substitutes for the endocrine disruptor DEHP in two hormone receptors. Journal of Biomolecular Structure and Dynamics, 40( 23), 12516–12525. doi:10.1080/07391102.2021.1971566.
NLM
Almeida M de O, Lanza MR de V, Honório KM. A study of possible substitutes for the endocrine disruptor DEHP in two hormone receptors [Internet]. Journal of Biomolecular Structure and Dynamics. 2022 ; 40( 23): 12516–12525.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2021.1971566.
Vancouver
Almeida M de O, Lanza MR de V, Honório KM. A study of possible substitutes for the endocrine disruptor DEHP in two hormone receptors [Internet]. Journal of Biomolecular Structure and Dynamics. 2022 ; 40( 23): 12516–12525.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2021.1971566.
Artigo de periodico
Electrochemistry applied to the evaluation of the interaction between coumarins and the copper metal ion: an experimental study with a DFT-Based analysis (2022)
Ferreira, Pedro Henrique de Lima; Bettanin, Fernanda ; Maltarollo, Vinicius G.; Honorio, Kathia Maria ; Ferreira, Tiago Luiz; Codognoto, Lucia; Valle, Eliana Maíra Agostini
Source: Journal of The Electrochemical Society. Unidade: EACH
Assunto: ELETROQUÍMICA
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FERREIRA, Pedro Henrique de Lima et al. Electrochemistry applied to the evaluation of the interaction between coumarins and the copper metal ion: an experimental study with a DFT-Based analysis. Journal of The Electrochemical Society, v. 169, n. 2, p. 01-08, 2022Tradução . . Disponível em: https://doi.org/10.1149/1945-7111/ac554b. Acesso em: 04 nov. 2024.
APA
Ferreira, P. H. de L., Bettanin, F., Maltarollo, V. G., Honorio, K. M., Ferreira, T. L., Codognoto, L., & Valle, E. M. A. (2022). Electrochemistry applied to the evaluation of the interaction between coumarins and the copper metal ion: an experimental study with a DFT-Based analysis. Journal of The Electrochemical Society, 169( 2), 01-08. doi:10.1149/1945-7111/ac554b
NLM
Ferreira PH de L, Bettanin F, Maltarollo VG, Honorio KM, Ferreira TL, Codognoto L, Valle EMA. Electrochemistry applied to the evaluation of the interaction between coumarins and the copper metal ion: an experimental study with a DFT-Based analysis [Internet]. Journal of The Electrochemical Society. 2022 ; 169( 2): 01-08.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1149/1945-7111/ac554b
Vancouver
Ferreira PH de L, Bettanin F, Maltarollo VG, Honorio KM, Ferreira TL, Codognoto L, Valle EMA. Electrochemistry applied to the evaluation of the interaction between coumarins and the copper metal ion: an experimental study with a DFT-Based analysis [Internet]. Journal of The Electrochemical Society. 2022 ; 169( 2): 01-08.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1149/1945-7111/ac554b
Artigo de periodico
Enzyme-catalyzed spiroacetal formation in polyketide antibiotic biosynthesis (2022)
Bilyk, Oksana ; Oliveira, Gabriel Stephani de ; Angelo, Rafaela Molina de ; Almeida, Michell de Oliveira ; Honorio, Kathia Maria ; Leeper, Finian James ; Dias, Marcio Vinicius Bertacine ; Leadlay, Peter F.
Source: Journal of American Chemical Society. Unidades: EACH, ICB, IQSC
Subjects: ELETROQUÍMICA, METABÓLITOS, ANTIBIÓTICOS, CATALASE, ENZIMAS OXIRREDUTORAS, ATIVAÇÃO ENZIMÁTICA, METABOLISMO SECUNDÁRIO, MICROBIOLOGIA
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BILYK, Oksana et al. Enzyme-catalyzed spiroacetal formation in polyketide antibiotic biosynthesis. Journal of American Chemical Society, v. 144, n. 32, p. 14555–14563, 2022Tradução . . Disponível em: https://doi.org/10.1021/jacs.2c03313. Acesso em: 04 nov. 2024.
APA
Bilyk, O., Oliveira, G. S. de, Angelo, R. M. de, Almeida, M. de O., Honorio, K. M., Leeper, F. J., et al. (2022). Enzyme-catalyzed spiroacetal formation in polyketide antibiotic biosynthesis. Journal of American Chemical Society, 144( 32), 14555–14563. doi:10.1021/jacs.2c03313
NLM
Bilyk O, Oliveira GS de, Angelo RM de, Almeida M de O, Honorio KM, Leeper FJ, Dias MVB, Leadlay PF. Enzyme-catalyzed spiroacetal formation in polyketide antibiotic biosynthesis [Internet]. Journal of American Chemical Society. 2022 ; 144( 32): 14555–14563.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1021/jacs.2c03313
Vancouver
Bilyk O, Oliveira GS de, Angelo RM de, Almeida M de O, Honorio KM, Leeper FJ, Dias MVB, Leadlay PF. Enzyme-catalyzed spiroacetal formation in polyketide antibiotic biosynthesis [Internet]. Journal of American Chemical Society. 2022 ; 144( 32): 14555–14563.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1021/jacs.2c03313
Artigo de periodico
Evaluating Deep Learning models for predicting ALK-5 inhibition (2021)
Espinoza, Gabriel Zarzana; Angelo, Rafaela Molina de ; Oliveira, Patrícia Rufino; Honório, Káthia Maria
Source: PLOS ONE. Unidade: EACH
Subjects: QUÍMICA MÉDICA, QUÍMICA FARMACÊUTICA, PLANEJAMENTO DE FÁRMACOS, NEOPLASIAS
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ESPINOZA, Gabriel Zarzana et al. Evaluating Deep Learning models for predicting ALK-5 inhibition. PLOS ONE, v. 16, n. ja 2021, p. 01-16, 2021Tradução . . Disponível em: https://doi.org/10.1371/journal.pone.0246126. Acesso em: 04 nov. 2024.
APA
Espinoza, G. Z., Angelo, R. M. de, Oliveira, P. R., & Honório, K. M. (2021). Evaluating Deep Learning models for predicting ALK-5 inhibition. PLOS ONE, 16( ja 2021), 01-16. doi:10.1371/journal.pone.0246126
NLM
Espinoza GZ, Angelo RM de, Oliveira PR, Honório KM. Evaluating Deep Learning models for predicting ALK-5 inhibition [Internet]. PLOS ONE. 2021 ; 16( ja 2021): 01-16.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1371/journal.pone.0246126
Vancouver
Espinoza GZ, Angelo RM de, Oliveira PR, Honório KM. Evaluating Deep Learning models for predicting ALK-5 inhibition [Internet]. PLOS ONE. 2021 ; 16( ja 2021): 01-16.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1371/journal.pone.0246126
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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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: 04 nov. 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 nov. 04 ] 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 nov. 04 ] Available from: https://doi.org/10.1007/s11224-021-01742-w
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
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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: 04 nov. 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 nov. 04 ] 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 nov. 04 ] Available from: https://doi.org/10.1016/j.jmgm.2021.107844
Artigo de periodico
Drug design of new 5-HT6 antagonists: a QSAR study of arylsulfonamide derivatives (2020)
Silva, Aldineia Pereira da; Angelo, Rafaela Machado de; Paula, Heberth De; Honório, Káthia Maria ; Silva, Alberico Borges Ferreira da
Source: Structural Chemistry: computational and experimental studies of chemical and biological systems. Unidades: EACH, IQSC
Assunto: QUÍMICA MÉDICA
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SILVA, Aldineia Pereira da et al. Drug design of new 5-HT6 antagonists: a QSAR study of arylsulfonamide derivatives. Structural Chemistry: computational and experimental studies of chemical and biological systems, v. 31, p. 1585–1597, 2020Tradução . . Disponível em: https://doi.org/10.1007/s11224-020-01513-z. Acesso em: 04 nov. 2024.
APA
Silva, A. P. da, Angelo, R. M. de, Paula, H. D., Honório, K. M., & Silva, A. B. F. da. (2020). Drug design of new 5-HT6 antagonists: a QSAR study of arylsulfonamide derivatives. Structural Chemistry: computational and experimental studies of chemical and biological systems, 31, 1585–1597. doi:10.1007/s11224-020-01513-z
NLM
Silva AP da, Angelo RM de, Paula HD, Honório KM, Silva ABF da. Drug design of new 5-HT6 antagonists: a QSAR study of arylsulfonamide derivatives [Internet]. Structural Chemistry: computational and experimental studies of chemical and biological systems. 2020 ; 31 1585–1597.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s11224-020-01513-z
Vancouver
Silva AP da, Angelo RM de, Paula HD, Honório KM, Silva ABF da. Drug design of new 5-HT6 antagonists: a QSAR study of arylsulfonamide derivatives [Internet]. Structural Chemistry: computational and experimental studies of chemical and biological systems. 2020 ; 31 1585–1597.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s11224-020-01513-z
Artigo de periodico
Computational analyses of interactions between ALK-5 and bioactive ligands: insights for the design of potential anticancer agents (2018)
Almeida, Michell O.; Costa, Clauber H.S.; Gomes, Guelber C.; Alves, Claudio N.; Honorio, Káthia Maria
Source: Journal of Biomolecular Structure & Dynamics. Unidade: EACH
Subjects: NEOPLASIAS, MODELAGEM MOLECULAR
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ALMEIDA, Michell O. et al. Computational analyses of interactions between ALK-5 and bioactive ligands: insights for the design of potential anticancer agents. Journal of Biomolecular Structure & Dynamics, v. 36, n. 15, p. 4010-4022, 2018Tradução . . Disponível em: https://doi.org/10.1080/07391102.2017.1404938. Acesso em: 04 nov. 2024.
APA
Almeida, M. O., Costa, C. H. S., Gomes, G. C., Alves, C. N., & Honorio, K. M. (2018). Computational analyses of interactions between ALK-5 and bioactive ligands: insights for the design of potential anticancer agents. Journal of Biomolecular Structure & Dynamics, 36( 15), 4010-4022. doi:10.1080/07391102.2017.1404938
NLM
Almeida MO, Costa CHS, Gomes GC, Alves CN, Honorio KM. Computational analyses of interactions between ALK-5 and bioactive ligands: insights for the design of potential anticancer agents [Internet]. Journal of Biomolecular Structure & Dynamics. 2018 ; 36( 15): 4010-4022.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2017.1404938
Vancouver
Almeida MO, Costa CHS, Gomes GC, Alves CN, Honorio KM. Computational analyses of interactions between ALK-5 and bioactive ligands: insights for the design of potential anticancer agents [Internet]. Journal of Biomolecular Structure & Dynamics. 2018 ; 36( 15): 4010-4022.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2017.1404938
Artigo de periodico
A molecular modeling study of combretastatin-like chalcones as anticancer agents using PLS, ANN and consensus models (2018)
Lipinski, Célio Fernando; Oliveira, Aline Alves; Honorio, Kathia Maria; Oliveira, Patrícia Rufino; Silva, Alberico Borges Ferreira da
Source: Structural Chemistry: computational and experimental studies of chemical and biological systems. Unidades: EACH, IQSC
Subjects: MICROTÚBULOS, NEOPLASIAS, BIOLOGIA MOLECULAR
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LIPINSKI, Célio Fernando et al. A molecular modeling study of combretastatin-like chalcones as anticancer agents using PLS, ANN and consensus models. Structural Chemistry: computational and experimental studies of chemical and biological systems, v. 29, p. 01-09, 2018Tradução . . Disponível em: https://doi.org/10.1007/s11224-017-1072-2. Acesso em: 04 nov. 2024.
APA
Lipinski, C. F., Oliveira, A. A., Honorio, K. M., Oliveira, P. R., & Silva, A. B. F. da. (2018). A molecular modeling study of combretastatin-like chalcones as anticancer agents using PLS, ANN and consensus models. Structural Chemistry: computational and experimental studies of chemical and biological systems, 29, 01-09. doi:10.1007/s11224-017-1072-2
NLM
Lipinski CF, Oliveira AA, Honorio KM, Oliveira PR, Silva ABF da. A molecular modeling study of combretastatin-like chalcones as anticancer agents using PLS, ANN and consensus models [Internet]. Structural Chemistry: computational and experimental studies of chemical and biological systems. 2018 ; 29 01-09.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s11224-017-1072-2
Vancouver
Lipinski CF, Oliveira AA, Honorio KM, Oliveira PR, Silva ABF da. A molecular modeling study of combretastatin-like chalcones as anticancer agents using PLS, ANN and consensus models [Internet]. Structural Chemistry: computational and experimental studies of chemical and biological systems. 2018 ; 29 01-09.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s11224-017-1072-2
Artigo de periodico
Molecular description of α-keto-based inhibitors of cruzain with activity against Chagas disease combining 3D-QSAR studies and molecular dynamics (2018)
Saraiva, Ádria P. B.; Miranda, Ricardo M.; Valente, Renan P. P.; Araújo, Jéssica O.; Souza, Rutelene N. B.; Costa, Clauber H. S.; Oliveira, Amanda R. S.; Almeida, Michell O.; Figueiredo, Antonio F.; Ferreira, João E. V.; Alves, Cláudio Nahum; Honorio, Káthia Maria
Source: Chemical Biology and Drug Design. Unidade: EACH
Subjects: DOENÇA DE CHAGAS, QUÍMICA MÉDICA, RELAÇÕES QUANTITATIVAS ENTRE ESTRUTURA QUÍMICA E ATIVIDADE BIOLÓGICA
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SARAIVA, Ádria P. B. et al. Molecular description of α-keto-based inhibitors of cruzain with activity against Chagas disease combining 3D-QSAR studies and molecular dynamics. Chemical Biology and Drug Design, p. 01-13, 2018Tradução . . Disponível em: https://doi.org/10.1111/cbdd.13313. Acesso em: 04 nov. 2024.
APA
Saraiva, Á. P. B., Miranda, R. M., Valente, R. P. P., Araújo, J. O., Souza, R. N. B., Costa, C. H. S., et al. (2018). Molecular description of α-keto-based inhibitors of cruzain with activity against Chagas disease combining 3D-QSAR studies and molecular dynamics. Chemical Biology and Drug Design, 01-13. doi:10.1111/cbdd.13313
NLM
Saraiva ÁPB, Miranda RM, Valente RPP, Araújo JO, Souza RNB, Costa CHS, Oliveira ARS, Almeida MO, Figueiredo AF, Ferreira JEV, Alves CN, Honorio KM. Molecular description of α-keto-based inhibitors of cruzain with activity against Chagas disease combining 3D-QSAR studies and molecular dynamics [Internet]. Chemical Biology and Drug Design. 2018 ; 01-13.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1111/cbdd.13313
Vancouver
Saraiva ÁPB, Miranda RM, Valente RPP, Araújo JO, Souza RNB, Costa CHS, Oliveira ARS, Almeida MO, Figueiredo AF, Ferreira JEV, Alves CN, Honorio KM. Molecular description of α-keto-based inhibitors of cruzain with activity against Chagas disease combining 3D-QSAR studies and molecular dynamics [Internet]. Chemical Biology and Drug Design. 2018 ; 01-13.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1111/cbdd.13313
Artigo de periodico
On the relationship of anthranilic derivatives structure and the FXR (Farnesoid X receptor) agonist activity (2018)
Kronenberger, Thales ; Windshügel, Björn ; Wrenger, Carsten ; Honório, Káthia Maria ; Maltarollo, Vinícius Gonçalves
Source: Journal of Biomolecular Structure & Dynamics. Unidades: ICB, EACH
Subjects: PARASITOLOGIA, HOMEOSTASE, DOENÇAS METABÓLICAS
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KRONENBERGER, Thales et al. On the relationship of anthranilic derivatives structure and the FXR (Farnesoid X receptor) agonist activity. Journal of Biomolecular Structure & Dynamics, v. 36, n. 16, p. 4378–4391, 2018Tradução . . Disponível em: https://doi.org/10.1080/07391102.2017.1417161. Acesso em: 04 nov. 2024.
APA
Kronenberger, T., Windshügel, B., Wrenger, C., Honório, K. M., & Maltarollo, V. G. (2018). On the relationship of anthranilic derivatives structure and the FXR (Farnesoid X receptor) agonist activity. Journal of Biomolecular Structure & Dynamics, 36( 16), 4378–4391. doi:10.1080/07391102.2017.1417161
NLM
Kronenberger T, Windshügel B, Wrenger C, Honório KM, Maltarollo VG. On the relationship of anthranilic derivatives structure and the FXR (Farnesoid X receptor) agonist activity [Internet]. Journal of Biomolecular Structure & Dynamics. 2018 ; 36( 16): 4378–4391.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2017.1417161
Vancouver
Kronenberger T, Windshügel B, Wrenger C, Honório KM, Maltarollo VG. On the relationship of anthranilic derivatives structure and the FXR (Farnesoid X receptor) agonist activity [Internet]. Journal of Biomolecular Structure & Dynamics. 2018 ; 36( 16): 4378–4391.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2017.1417161
Artigo de periodico
New consensus multivariate models based on PLS and ANN studies of sigma-1 receptor antagonists (2017)
Oliveira, Aline A; Lipinski, Célio F; Pereira, Estevão B; Honório, Káthia Maria; Oliveira, Patrícia Rufino; Weber, Karen C; Romero, Roseli Aparecida Francelin ; Sousa, Alexsandro G. de; Silva, Alberico Borges Ferreira da
Source: Journal of Molecular Modeling. Unidades: EACH, ICMC, IQSC
Subjects: FARMACOLOGIA MOLECULAR, RECEPTORES, MODELOS (ANÁLISE MULTIVARIADA), REDES NEURAIS
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OLIVEIRA, Aline A et al. New consensus multivariate models based on PLS and ANN studies of sigma-1 receptor antagonists. Journal of Molecular Modeling, v. 23, p. 1-15, 2017Tradução . . Disponível em: https://doi.org/10.1007/s00894-017-3444-3. Acesso em: 04 nov. 2024.
APA
Oliveira, A. A., Lipinski, C. F., Pereira, E. B., Honório, K. M., Oliveira, P. R., Weber, K. C., et al. (2017). New consensus multivariate models based on PLS and ANN studies of sigma-1 receptor antagonists. Journal of Molecular Modeling, 23, 1-15. doi:10.1007/s00894-017-3444-3
NLM
Oliveira AA, Lipinski CF, Pereira EB, Honório KM, Oliveira PR, Weber KC, Romero RAF, Sousa AG de, Silva ABF da. New consensus multivariate models based on PLS and ANN studies of sigma-1 receptor antagonists [Internet]. Journal of Molecular Modeling. 2017 ; 23 1-15.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s00894-017-3444-3
Vancouver
Oliveira AA, Lipinski CF, Pereira EB, Honório KM, Oliveira PR, Weber KC, Romero RAF, Sousa AG de, Silva ABF da. New consensus multivariate models based on PLS and ANN studies of sigma-1 receptor antagonists [Internet]. Journal of Molecular Modeling. 2017 ; 23 1-15.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s00894-017-3444-3
Artigo de periodico
In silico studies on the interaction between bioactive ligands and ALK5, a biological target related to the cancer treatment (2016)
Almeida, M. O; Trossini, Gustavo Henrique Goulart ; Maltarollo, Vinícius Gonçalves; Silva, Danielle D; Honório, Kathia Maria
Source: Journal of Biomolecular Structure and Dynamics. Unidades: FCF, EACH
Subjects: ANTI-INFLAMATÓRIOS, LIGANTES
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ABNT
ALMEIDA, M. O et al. In silico studies on the interaction between bioactive ligands and ALK5, a biological target related to the cancer treatment. Journal of Biomolecular Structure and Dynamics, v. 34, n. 9, p. 2045-2053, 2016Tradução . . Disponível em: https://doi.org/10.1080/07391102.2015.1106340. Acesso em: 04 nov. 2024.
APA
Almeida, M. O., Trossini, G. H. G., Maltarollo, V. G., Silva, D. D., & Honório, K. M. (2016). In silico studies on the interaction between bioactive ligands and ALK5, a biological target related to the cancer treatment. Journal of Biomolecular Structure and Dynamics, 34( 9), 2045-2053. doi:10.1080/07391102.2015.1106340
NLM
Almeida MO, Trossini GHG, Maltarollo VG, Silva DD, Honório KM. In silico studies on the interaction between bioactive ligands and ALK5, a biological target related to the cancer treatment [Internet]. Journal of Biomolecular Structure and Dynamics. 2016 ; 34( 9): 2045-2053.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2015.1106340
Vancouver
Almeida MO, Trossini GHG, Maltarollo VG, Silva DD, Honório KM. In silico studies on the interaction between bioactive ligands and ALK5, a biological target related to the cancer treatment [Internet]. Journal of Biomolecular Structure and Dynamics. 2016 ; 34( 9): 2045-2053.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1080/07391102.2015.1106340
Artigo de periodico
Benchmark studies of UV-vis spectra simulation for cinnamates with UV filter profile (2015)
Garcia, Ricardo D'A; Maltarollo, Vinícius Gonçalves; Honório, Kathia Maria; Trossini, Gustavo Henrique Goulart
Source: Journal of Molecular Modeling. Unidades: EACH, FCF
Subjects: MODELAGEM MOLECULAR, ESPECTROSCOPIA ULTRAVIOLETA
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ABNT
GARCIA, Ricardo D'A et al. Benchmark studies of UV-vis spectra simulation for cinnamates with UV filter profile. Journal of Molecular Modeling, v. 21, p. 1-13 art. 150, 2015Tradução . . Disponível em: https://doi.org/10.1007/s00894-015-2689-y. Acesso em: 04 nov. 2024.
APA
Garcia, R. D. 'A., Maltarollo, V. G., Honório, K. M., & Trossini, G. H. G. (2015). Benchmark studies of UV-vis spectra simulation for cinnamates with UV filter profile. Journal of Molecular Modeling, 21, 1-13 art. 150. doi:10.1007/s00894-015-2689-y
NLM
Garcia RD'A, Maltarollo VG, Honório KM, Trossini GHG. Benchmark studies of UV-vis spectra simulation for cinnamates with UV filter profile [Internet]. Journal of Molecular Modeling. 2015 ; 21 1-13 art. 150.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s00894-015-2689-y
Vancouver
Garcia RD'A, Maltarollo VG, Honório KM, Trossini GHG. Benchmark studies of UV-vis spectra simulation for cinnamates with UV filter profile [Internet]. Journal of Molecular Modeling. 2015 ; 21 1-13 art. 150.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1007/s00894-015-2689-y
Artigo de periodico
Structure-based virtual screening and discovery of new PPARδ/γ dual agonist and PPARδ and γ agonists (2015)
Maltarollo, Vinicius G.; Togashi, Marie; Nascimento, Alessandro Silva ; Honório, Kathia Maria
Source: PLoS ONE. Unidades: IFSC, EACH
Subjects: DIABETES MELLITUS, DOENÇAS METABÓLICAS (TRATAMENTO)
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ABNT
MALTAROLLO, Vinicius G. et al. Structure-based virtual screening and discovery of new PPARδ/γ dual agonist and PPARδ and γ agonists. PLoS ONE, v. 10, n. 3, p. e0118790-1-e0118790-16, 2015Tradução . . Disponível em: https://doi.org/10.1371/journal.pone.0118790. Acesso em: 04 nov. 2024.
APA
Maltarollo, V. G., Togashi, M., Nascimento, A. S., & Honório, K. M. (2015). Structure-based virtual screening and discovery of new PPARδ/γ dual agonist and PPARδ and γ agonists. PLoS ONE, 10( 3), e0118790-1-e0118790-16. doi:10.1371/journal.pone.0118790
NLM
Maltarollo VG, Togashi M, Nascimento AS, Honório KM. Structure-based virtual screening and discovery of new PPARδ/γ dual agonist and PPARδ and γ agonists [Internet]. PLoS ONE. 2015 ;10( 3): e0118790-1-e0118790-16.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1371/journal.pone.0118790
Vancouver
Maltarollo VG, Togashi M, Nascimento AS, Honório KM. Structure-based virtual screening and discovery of new PPARδ/γ dual agonist and PPARδ and γ agonists [Internet]. PLoS ONE. 2015 ;10( 3): e0118790-1-e0118790-16.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1371/journal.pone.0118790
Artigo de periodico
Molecular features related to HIV integrase inhibition obtained from structure- and ligand-based approaches (2014)
Carvalho, Luciana L de; Maltarollo, Vinícius Gonçalves; Lima, Emmanuela Ferreira de; Weber, Karen Cacilda; Honório, Kathia Maria; Silva, Alberico Borges Ferreira da
Source: PLoS ONE. Unidades: EACH, IQSC
Subjects: RELAÇÕES QUANTITATIVAS ENTRE ESTRUTURA QUÍMICA E ATIVIDADE BIOLÓGICA, HIV
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ABNT
CARVALHO, Luciana L de et al. Molecular features related to HIV integrase inhibition obtained from structure- and ligand-based approaches. PLoS ONE, v. 9, n. ja 2014, p. e81301-1 - e81301-9, 2014Tradução . . Disponível em: https://doi.org/10.1371/journal.pone.0081301. Acesso em: 04 nov. 2024.
APA
Carvalho, L. L. de, Maltarollo, V. G., Lima, E. F. de, Weber, K. C., Honório, K. M., & Silva, A. B. F. da. (2014). Molecular features related to HIV integrase inhibition obtained from structure- and ligand-based approaches. PLoS ONE, 9( ja 2014), e81301-1 - e81301-9. doi:10.1371/journal.pone.0081301
NLM
Carvalho LL de, Maltarollo VG, Lima EF de, Weber KC, Honório KM, Silva ABF da. Molecular features related to HIV integrase inhibition obtained from structure- and ligand-based approaches [Internet]. PLoS ONE. 2014 ; 9( ja 2014): e81301-1 - e81301-9.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1371/journal.pone.0081301
Vancouver
Carvalho LL de, Maltarollo VG, Lima EF de, Weber KC, Honório KM, Silva ABF da. Molecular features related to HIV integrase inhibition obtained from structure- and ligand-based approaches [Internet]. PLoS ONE. 2014 ; 9( ja 2014): e81301-1 - e81301-9.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1371/journal.pone.0081301
Artigo de periodico
A novel phospholipase A2 (D49) from the venom of the Crotalus oreganus abyssus (North American Grand Canyon Rattlesnake) (2014)
Castro, Walessa Martins de; Baldasso, Paulo Aparecido; Honório, Kathia Maria; Maltarollo, Vinícius Gonçalves; Ribeiro, Rosy Iara Maciel Azambuja; Carvalho, Bruna Mara Aparecida de; Soares, Andreimar Martins; Calderon, Leonardo de Azevedo; Stábeli, Rodrigo Guerino; Odena Caballol, Maria Antonia; Acosta, Gerardo A.; Oliveira, Eliandre de; Marangoni, Sérgio; Alberício, Fernando; Silva, Saulo Luís da
Source: BioMed Research International. Unidade: EACH
Subjects: ANÁLISE DE SEQUÊNCIA DE DNA, DNA MITOCONDRIAL, FOSFOLIPASES A, VENENOS DE ORIGEM ANIMAL, VIPERIDAE, COBRAS
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ABNT
CASTRO, Walessa Martins de et al. A novel phospholipase A2 (D49) from the venom of the Crotalus oreganus abyssus (North American Grand Canyon Rattlesnake). BioMed Research International, v. 2014, p. 1-15, 2014Tradução . . Disponível em: https://doi.org/10.1155/2014/654170. Acesso em: 04 nov. 2024.
APA
Castro, W. M. de, Baldasso, P. A., Honório, K. M., Maltarollo, V. G., Ribeiro, R. I. M. A., Carvalho, B. M. A. de, et al. (2014). A novel phospholipase A2 (D49) from the venom of the Crotalus oreganus abyssus (North American Grand Canyon Rattlesnake). BioMed Research International, 2014, 1-15. doi:10.1155/2014/654170
NLM
Castro WM de, Baldasso PA, Honório KM, Maltarollo VG, Ribeiro RIMA, Carvalho BMA de, Soares AM, Calderon L de A, Stábeli RG, Odena Caballol MA, Acosta GA, Oliveira E de, Marangoni S, Alberício F, Silva SL da. A novel phospholipase A2 (D49) from the venom of the Crotalus oreganus abyssus (North American Grand Canyon Rattlesnake) [Internet]. BioMed Research International. 2014 ; 2014 1-15.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1155/2014/654170
Vancouver
Castro WM de, Baldasso PA, Honório KM, Maltarollo VG, Ribeiro RIMA, Carvalho BMA de, Soares AM, Calderon L de A, Stábeli RG, Odena Caballol MA, Acosta GA, Oliveira E de, Marangoni S, Alberício F, Silva SL da. A novel phospholipase A2 (D49) from the venom of the Crotalus oreganus abyssus (North American Grand Canyon Rattlesnake) [Internet]. BioMed Research International. 2014 ; 2014 1-15.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1155/2014/654170
Artigo de periodico
Isolation and biochemical characterization of a new thrombin-like serine protease from Bothrops pirajai snake venom (2014)
Zaqueo, Kayena Delaix; Kayano, Anderson Makoto; Silva, Rodrigo Simões; Dill, Leandro Soares Moreira; Fernandes, Carla Freire Celedonio; Fuly, André Lopes; Maltarollo, Vinícius Gonçalves; Honório, Kathia Maria; Silva, Saulo Luís da; Acosta, Gerardo A.; Odena Caballol, Maria Antonia; Oliveira, Eliandre de; Alberício, Fernando; Calderon, Leonardo de Azevedo; Soares, Andreimar Martins; Stábeli, Rodrigo Guerino
Source: BioMed Research International. Unidade: EACH
Subjects: BIOQUÍMICA ANIMAL, CITOQUÍMICA, VENENOS DE ORIGEM ANIMAL, VIPERIDAE, COBRAS
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ABNT
ZAQUEO, Kayena Delaix et al. Isolation and biochemical characterization of a new thrombin-like serine protease from Bothrops pirajai snake venom. BioMed Research International, v. 2014, p. [1-13], 2014Tradução . . Disponível em: https://doi.org/10.1155/2014/595186. Acesso em: 04 nov. 2024.
APA
Zaqueo, K. D., Kayano, A. M., Silva, R. S., Dill, L. S. M., Fernandes, C. F. C., Fuly, A. L., et al. (2014). Isolation and biochemical characterization of a new thrombin-like serine protease from Bothrops pirajai snake venom. BioMed Research International, 2014, [1-13]. doi:10.1155/2014/595186
NLM
Zaqueo KD, Kayano AM, Silva RS, Dill LSM, Fernandes CFC, Fuly AL, Maltarollo VG, Honório KM, Silva SL da, Acosta GA, Odena Caballol MA, Oliveira E de, Alberício F, Calderon L de A, Soares AM, Stábeli RG. Isolation and biochemical characterization of a new thrombin-like serine protease from Bothrops pirajai snake venom [Internet]. BioMed Research International. 2014 ; 2014 [1-13].[citado 2024 nov. 04 ] Available from: https://doi.org/10.1155/2014/595186
Vancouver
Zaqueo KD, Kayano AM, Silva RS, Dill LSM, Fernandes CFC, Fuly AL, Maltarollo VG, Honório KM, Silva SL da, Acosta GA, Odena Caballol MA, Oliveira E de, Alberício F, Calderon L de A, Soares AM, Stábeli RG. Isolation and biochemical characterization of a new thrombin-like serine protease from Bothrops pirajai snake venom [Internet]. BioMed Research International. 2014 ; 2014 [1-13].[citado 2024 nov. 04 ] Available from: https://doi.org/10.1155/2014/595186
Artigo de periodico
Molecular modeling studies on molecular properties of mutagenic flavonoids (2013)
Maltarollo, Vinícius Gonçalves; Honório, Kathia Maria; Sannomiya, Míriam
Source: Journal of Computational and Theoretical Nanoscience. Unidade: EACH
Assunto: MODELAGEM MOLECULAR
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ABNT
MALTAROLLO, Vinícius Gonçalves e HONÓRIO, Kathia Maria e SANNOMIYA, Míriam. Molecular modeling studies on molecular properties of mutagenic flavonoids. Journal of Computational and Theoretical Nanoscience, v. 10, n. 6, p. 1385-1390, 2013Tradução . . Disponível em: https://doi.org/10.1166/jctn.2013.2859. Acesso em: 04 nov. 2024.
APA
Maltarollo, V. G., Honório, K. M., & Sannomiya, M. (2013). Molecular modeling studies on molecular properties of mutagenic flavonoids. Journal of Computational and Theoretical Nanoscience, 10( 6), 1385-1390. doi:10.1166/jctn.2013.2859
NLM
Maltarollo VG, Honório KM, Sannomiya M. Molecular modeling studies on molecular properties of mutagenic flavonoids [Internet]. Journal of Computational and Theoretical Nanoscience. 2013 ; 10( 6): 1385-1390.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1166/jctn.2013.2859
Vancouver
Maltarollo VG, Honório KM, Sannomiya M. Molecular modeling studies on molecular properties of mutagenic flavonoids [Internet]. Journal of Computational and Theoretical Nanoscience. 2013 ; 10( 6): 1385-1390.[citado 2024 nov. 04 ] Available from: https://doi.org/10.1166/jctn.2013.2859

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