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Anti-inflammatory biomolecular activity of chlorinated-phenyldiazenyl-naphthalene-2-sulfonic acid derivatives: perception from DFT, molecular docking, and molecular dynamic simulation.
Udoikono, Akaninyene D; Agwamba, Ernest C; Louis, Hitler; Benjamin, Innocent; Ahmad, Iqrar; Ejiofor, Emmanuel U; Ahuekwe, Eze F; Chukwuemeka, Kelechi; Adeyinka, Adedapo S; Patel, Harun M; Manicum, Amanda-Lee; Edim, Moses.
Afiliación
  • Udoikono AD; Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria.
  • Agwamba EC; Department of Pure and Applied Chemistry, Faculty of Physical Sciences, University of Calabar, Calabar, Nigeria.
  • Louis H; Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria.
  • Benjamin I; Department of Chemical Sciences, Clifford University Owerrinta, Nigeria.
  • Ahmad I; Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria.
  • Ejiofor EU; Department of Pure and Applied Chemistry, Faculty of Physical Sciences, University of Calabar, Calabar, Nigeria.
  • Ahuekwe EF; Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria.
  • Chukwuemeka K; Department of Biological Sciences, Covenant University, Ota, Nigeria.
  • Adeyinka AS; Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria.
  • Patel HM; Department of Chemical Sciences, Clifford University Owerrinta, Nigeria.
  • Manicum AL; Computational and Bio-Simulation Research Group, University of Calabar, Calabar, Nigeria.
  • Edim M; Department of Biological Sciences, Covenant University, Ota, Nigeria.
J Biomol Struct Dyn ; 41(19): 10136-10160, 2023 11.
Article en En | MEDLINE | ID: mdl-36519503
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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Asunto principal: Simulación de Dinámica Molecular / Antiinflamatorios Límite: Animals Idioma: En Revista: J Biomol Struct Dyn Año: 2023 Tipo del documento: Article País de afiliación: Nigeria Pais de publicación: Reino Unido
Texto completo
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PubMed Links
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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Asunto principal: Simulación de Dinámica Molecular / Antiinflamatorios Límite: Animals Idioma: En Revista: J Biomol Struct Dyn Año: 2023 Tipo del documento: Article País de afiliación: Nigeria Pais de publicación: Reino Unido