Discovery of potentially biased agonists of mu-opioid receptor (MOR) through molecular docking, pharmacophore modeling, and MD simulation
Xuan Jiang, Shuxiang Li, Hongbin Zhang, Liang‐Liang Wang
Topics & Concepts
PharmacophoreDocking (animal)ChemistryVirtual screeningOpioidMolecular dynamicsG protein-coupled receptorSmall moleculeComputational biologyPharmacologyStereochemistryReceptorBiochemistryBiologyMedicineComputational chemistryNursingReceptor Mechanisms and SignalingComputational Drug Discovery MethodsNeuropeptides and Animal Physiology