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Pharmacophore modeling, docking and molecular dynamics simulation for identification of novel human protein kinase C beta (PKCß) inhibitors.
Starosyla, Sergiy A; Volynets, Galyna P; Protopopov, Mykola V; Bdzhola, Volodymyr G; Pashevin, Denis O; Polishchuk, Valentyna O; Kozak, Taisiia O; Stroi, Dmytro O; Dosenko, Victor E; Yarmoluk, Sergiy M.
Afiliação
  • Starosyla SA; 150 Zabolotnogo St, Kyiv, 03143 Ukraine Department of Medicinal Chemistry, Institute of Molecular Biology and Genetics, NAS of Ukraine.
  • Volynets GP; RECEPTOR.AI, Boston, MA USA.
  • Protopopov MV; 150 Zabolotnogo St, Kyiv, 03143 Ukraine Department of Medicinal Chemistry, Institute of Molecular Biology and Genetics, NAS of Ukraine.
  • Bdzhola VG; 150 Zabolotnogo St, Kyiv, 03143 Ukraine Department of Medicinal Chemistry, Institute of Molecular Biology and Genetics, NAS of Ukraine.
  • Pashevin DO; 150 Zabolotnogo St, Kyiv, 03143 Ukraine Department of Medicinal Chemistry, Institute of Molecular Biology and Genetics, NAS of Ukraine.
  • Polishchuk VO; Kyiv, 01024 Ukraine Department of General and Molecular Pathophysiology, Bogomoletz Institute of Physiology.
  • Kozak TO; Kyiv, 01024 Ukraine Department of General and Molecular Pathophysiology, Bogomoletz Institute of Physiology.
  • Stroi DO; Kyiv, 01024 Ukraine Department of General and Molecular Pathophysiology, Bogomoletz Institute of Physiology.
  • Dosenko VE; Kyiv, 01024 Ukraine Department of General and Molecular Pathophysiology, Bogomoletz Institute of Physiology.
  • Yarmoluk SM; Kyiv, 01024 Ukraine Department of General and Molecular Pathophysiology, Bogomoletz Institute of Physiology.
Struct Chem ; 34(3): 1157-1171, 2023.
Article em En | MEDLINE | ID: mdl-36248344
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Tipo de estudo: Diagnostic_studies / Prognostic_studies Idioma: En Revista: Struct Chem Ano de publicação: 2023 Tipo de documento: Article
Texto completo
Imprimir
XML
PubMed Links
Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Tipo de estudo: Diagnostic_studies / Prognostic_studies Idioma: En Revista: Struct Chem Ano de publicação: 2023 Tipo de documento: Article