Filtros : "Journal of Molecular Modeling" "QUÍMICA TEÓRICA" Limpar

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  • Source: Journal of Molecular Modeling. Unidade: IQSC

    Subjects: ESTRUTURA ELETRÔNICA, QUÍMICA TEÓRICA, HIDROGÊNIO

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    • ABNT

      VICHIETTI, Rafael M. et al. Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment. Journal of Molecular Modeling, v. 28, p. 229, 2022Tradução . . Disponível em: https://doi.org/10.1007/s00894-022-05207-7. Acesso em: 09 nov. 2025.
    • APA

      Vichietti, R. M., Spada, R. F. K., Machado, F. B. C., & Haiduke, R. L. A. (2022). Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment. Journal of Molecular Modeling, 28, 229. doi:10.1007/s00894-022-05207-7
    • NLM

      Vichietti RM, Spada RFK, Machado FBC, Haiduke RLA. Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment [Internet]. Journal of Molecular Modeling. 2022 ;28 229.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-022-05207-7
    • Vancouver

      Vichietti RM, Spada RFK, Machado FBC, Haiduke RLA. Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment [Internet]. Journal of Molecular Modeling. 2022 ;28 229.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-022-05207-7
  • Source: Journal of Molecular Modeling. Unidade: IQSC

    Subjects: QUÍMICA TEÓRICA, POLARIZAÇÃO, MOLÉCULA

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    • ABNT

      MARINGOLO, Milena Palhares et al. On polarization functions for Gaussian basis sets. Journal of Molecular Modeling, v. 26, p. 293 sept.2020, 2020Tradução . . Disponível em: https://doi.org/10.1007/s00894-020-04538-7. Acesso em: 09 nov. 2025.
    • APA

      Maringolo, M. P., Tello, A. C. M., Guimaraes, A. R., Alves, J. M. A., Lima, F. das C. A., Longo, E., & Silva, A. B. F. da. (2020). On polarization functions for Gaussian basis sets. Journal of Molecular Modeling, 26, 293 sept.2020. doi:10.1007/s00894-020-04538-7
    • NLM

      Maringolo MP, Tello ACM, Guimaraes AR, Alves JMA, Lima F das CA, Longo E, Silva ABF da. On polarization functions for Gaussian basis sets [Internet]. Journal of Molecular Modeling. 2020 ; 26 293 sept.2020.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-020-04538-7
    • Vancouver

      Maringolo MP, Tello ACM, Guimaraes AR, Alves JMA, Lima F das CA, Longo E, Silva ABF da. On polarization functions for Gaussian basis sets [Internet]. Journal of Molecular Modeling. 2020 ; 26 293 sept.2020.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-020-04538-7
  • Source: Journal of Molecular Modeling. Unidade: IQSC

    Assunto: QUÍMICA TEÓRICA

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    • ABNT

      MOLFETTA, Fábio Alberto de et al. Docking and molecular dynamics simulation of quinone compounds with trypanocidal activity. Journal of Molecular Modeling, v. 15, n. 10, p. 1175-1184, 2009Tradução . . Disponível em: https://doi.org/10.1007/s00894-009-0468-3. Acesso em: 09 nov. 2025.
    • APA

      Molfetta, F. A. de, Freitas, R. F. de, Silva, A. B. F. da, & Montanari, C. A. (2009). Docking and molecular dynamics simulation of quinone compounds with trypanocidal activity. Journal of Molecular Modeling, 15( 10), 1175-1184. doi:10.1007/s00894-009-0468-3
    • NLM

      Molfetta FA de, Freitas RF de, Silva ABF da, Montanari CA. Docking and molecular dynamics simulation of quinone compounds with trypanocidal activity [Internet]. Journal of Molecular Modeling. 2009 ; 15( 10): 1175-1184.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-009-0468-3
    • Vancouver

      Molfetta FA de, Freitas RF de, Silva ABF da, Montanari CA. Docking and molecular dynamics simulation of quinone compounds with trypanocidal activity [Internet]. Journal of Molecular Modeling. 2009 ; 15( 10): 1175-1184.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-009-0468-3
  • Source: Journal of Molecular Modeling. Unidades: ICMC, IQSC

    Assunto: QUÍMICA TEÓRICA

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    • ABNT

      MOLFETTA, Fábio Alberto de et al. A neural networks study of quinone compounds with trypanocidal activity. Journal of Molecular Modeling, v. 14, n. 10, p. 975-985, 2008Tradução . . Disponível em: https://doi.org/10.1007/s00894-008-0332-x. Acesso em: 09 nov. 2025.
    • APA

      Molfetta, F. A. de, Angelotti, W. F. D., Romero, R. A. F., Montanari, C. A., & Silva, A. B. F. da. (2008). A neural networks study of quinone compounds with trypanocidal activity. Journal of Molecular Modeling, 14( 10), 975-985. doi:10.1007/s00894-008-0332-x
    • NLM

      Molfetta FA de, Angelotti WFD, Romero RAF, Montanari CA, Silva ABF da. A neural networks study of quinone compounds with trypanocidal activity [Internet]. Journal of Molecular Modeling. 2008 ; 14( 10): 975-985.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-008-0332-x
    • Vancouver

      Molfetta FA de, Angelotti WFD, Romero RAF, Montanari CA, Silva ABF da. A neural networks study of quinone compounds with trypanocidal activity [Internet]. Journal of Molecular Modeling. 2008 ; 14( 10): 975-985.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-008-0332-x
  • Source: Journal of Molecular Modeling. Unidades: IQSC, EACH

    Assunto: QUÍMICA TEÓRICA

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    • ABNT

      WEBER, Karen Cacilda et al. The use of classification methods for modeling the antioxidant activity of flavonoid compounds. Journal of Molecular Modeling, v. 12, n. 6, p. 915-920, 2006Tradução . . Disponível em: https://doi.org/10.1007/s00894-005-0083-x. Acesso em: 09 nov. 2025.
    • APA

      Weber, K. C., Honório, K. M., Bruni, A. T., & Silva, A. B. F. da. (2006). The use of classification methods for modeling the antioxidant activity of flavonoid compounds. Journal of Molecular Modeling, 12( 6), 915-920. doi:10.1007/s00894-005-0083-x
    • NLM

      Weber KC, Honório KM, Bruni AT, Silva ABF da. The use of classification methods for modeling the antioxidant activity of flavonoid compounds [Internet]. Journal of Molecular Modeling. 2006 ; 12( 6): 915-920.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-005-0083-x
    • Vancouver

      Weber KC, Honório KM, Bruni AT, Silva ABF da. The use of classification methods for modeling the antioxidant activity of flavonoid compounds [Internet]. Journal of Molecular Modeling. 2006 ; 12( 6): 915-920.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-005-0083-x
  • Source: Journal of Molecular Modeling. Unidade: IQSC

    Assunto: QUÍMICA TEÓRICA

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    • ABNT

      HONÓRIO, Káthia Maria e SILVA, Alberico Borges Ferreira da. A study on the influence of molecular properties in the psychoactivity of cannabinoid compounds. Journal of Molecular Modeling, v. 11, n. 3, p. 200-209, 2005Tradução . . Disponível em: https://doi.org/10.1007/s00894-005-0243-z. Acesso em: 09 nov. 2025.
    • APA

      Honório, K. M., & Silva, A. B. F. da. (2005). A study on the influence of molecular properties in the psychoactivity of cannabinoid compounds. Journal of Molecular Modeling, 11( 3), 200-209. doi:10.1007/s00894-005-0243-z
    • NLM

      Honório KM, Silva ABF da. A study on the influence of molecular properties in the psychoactivity of cannabinoid compounds [Internet]. Journal of Molecular Modeling. 2005 ;11( 3): 200-209.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-005-0243-z
    • Vancouver

      Honório KM, Silva ABF da. A study on the influence of molecular properties in the psychoactivity of cannabinoid compounds [Internet]. Journal of Molecular Modeling. 2005 ;11( 3): 200-209.[citado 2025 nov. 09 ] Available from: https://doi.org/10.1007/s00894-005-0243-z

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