Pharmacotherapeutic Potential of Natural Products to Target the SARS-CoV-2 PLpro Using Molecular Screening and Simulation Approaches
Abrar Mohammad Sayaf, Hassaan Ahmad, Muhammad Ammar Aslam, Sidra Abdul Ghani, Saira Bano, Qudsia Yousafi, Muhammad Suleman, Abbas Khan, Kar Kheng Yeoh, Dong‐Qing Wei
Topics & Concepts
Docking (animal)Molecular dynamicsChemistryComputational biologyStereochemistrySmall moleculeDrugLigand (biochemistry)Combinatorial chemistryBiologyBiochemistryComputational chemistryReceptorPharmacologyMedicineNursingComputational Drug Discovery MethodsCancer therapeutics and mechanismsPhenothiazines and Benzothiazines Synthesis and Activities