Identification of natural inhibitors to inhibit C. acnes lipase through docking and simulation studies
Akash Pratap Singh, Hemant Arya, Vijay Singh, Pradeep Kumar, Hemant K. Gautam
Topics & Concepts
Docking (animal)Active siteProtein Data Bank (RCSB PDB)LipaseChemistryBiochemistryIn silicoOxyanion holeVirtual screeningBinding siteEnzymeDrug discoveryComputational biologyBiologyMedicineGeneNursingAcne and Rosacea Treatments and EffectsComputational Drug Discovery MethodsPharmacological Effects of Natural Compounds