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In silico design of novel CDK2 inhibitors through QSAR, ADMET, molecular docking and molecular dynamics simulation studies.
Moussaoui, Mohamed; Baassi, Mouna; Baammi, Soukayna; Soufi, Hatim; Salah, Mohammed; Daoud, Rachid; El Allali, Achraf; Belghiti, M E; Belaaouad, Said.
Afiliação
  • Moussaoui M; Laboratory of Physical Chemistry of Materials, Faculty of Sciences Ben M'Sick, Hassan II University of Casablanca, Casablanca, Morocco.
  • Baassi M; Laboratory of Physical Chemistry of Materials, Faculty of Sciences Ben M'Sick, Hassan II University of Casablanca, Casablanca, Morocco.
  • Baammi S; African Genome Centre (AGC), Mohammed VI Polytechnic University, Benguerir, Morocco.
  • Soufi H; Laboratory of Physical Chemistry of Materials, Faculty of Sciences Ben M'Sick, Hassan II University of Casablanca, Casablanca, Morocco.
  • Salah M; Team of Chemoinformatics Research and Spectroscopy and Quantum Chemistry, Department of chemistry, Faculty of Science, University Chouaib Doukkali, El Jadida, Morocco.
  • Daoud R; African Genome Centre (AGC), Mohammed VI Polytechnic University, Benguerir, Morocco.
  • El Allali A; African Genome Centre (AGC), Mohammed VI Polytechnic University, Benguerir, Morocco.
  • Belghiti ME; Laboratory of Physical Chemistry of Materials, Faculty of Sciences Ben M'Sick, Hassan II University of Casablanca, Casablanca, Morocco.
  • Belaaouad S; Laboratory of Nernest Technology, Sherbrook, Quebec, Canada.
J Biomol Struct Dyn ; 41(23): 13646-13662, 2023.
Article em En | MEDLINE | ID: mdl-37203327

Texto completo: 1 Coleções: 01-internacional Temas: Geral / Tipos_de_cancer / Outros_tipos Base de dados: MEDLINE Assunto principal: Carcinoma Hepatocelular / Neoplasias Hepáticas Tipo de estudo: Prognostic_studies Limite: Humans Idioma: En Revista: J Biomol Struct Dyn Ano de publicação: 2023 Tipo de documento: Article País de afiliação: Marrocos

Texto completo: 1 Coleções: 01-internacional Temas: Geral / Tipos_de_cancer / Outros_tipos Base de dados: MEDLINE Assunto principal: Carcinoma Hepatocelular / Neoplasias Hepáticas Tipo de estudo: Prognostic_studies Limite: Humans Idioma: En Revista: J Biomol Struct Dyn Ano de publicação: 2023 Tipo de documento: Article País de afiliação: Marrocos