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Discovery of Novel and Highly Potent Inhibitors of SARS CoV-2 Papain-Like Protease Through Structure-Based Pharmacophore Modeling, Virtual Screening, Molecular Docking, Molecular Dynamics Simulations, and Biological Evaluation.
Tian, Xiaoyan; Zhao, Quanfeng; Chen, Xiaohong; Peng, Zhe; Tan, Xiaodan; Wang, Qin; Chen, Lin; Yang, Yang.
Affiliation
  • Tian X; Department of Pharmacology, Chongqing Health Center for Women and Children, Chongqing, China.
  • Zhao Q; Department of Pharmacy, Southwest Hospital, First Affiliated Hospital to TMMU, Third Military Medical University (Army Medical University), Chongqing, China.
  • Chen X; Department of Pharmacology, Chongqing Health Center for Women and Children, Chongqing, China.
  • Peng Z; Department of Pharmacology, Chongqing Health Center for Women and Children, Chongqing, China.
  • Tan X; Department of Pharmacology, Chongqing Health Center for Women and Children, Chongqing, China.
  • Wang Q; Department of Pharmacology, Chongqing Hospital of Traditional Chinese Medicine, Chongqing, China.
  • Chen L; Department of Pharmacology, Chongqing Health Center for Women and Children, Chongqing, China.
  • Yang Y; Department of Pharmacology, Chongqing Health Center for Women and Children, Chongqing, China.
Front Pharmacol ; 13: 817715, 2022.
Article in En | MEDLINE | ID: mdl-35264955

Full text: 1 Collection: 01-internacional Database: MEDLINE Type of study: Diagnostic_studies / Prognostic_studies / Screening_studies Language: En Journal: Front Pharmacol Year: 2022 Document type: Article

Full text: 1 Collection: 01-internacional Database: MEDLINE Type of study: Diagnostic_studies / Prognostic_studies / Screening_studies Language: En Journal: Front Pharmacol Year: 2022 Document type: Article