Deciphering non-covalent binding mechanism of olive biophenolic secoiridoids interaction with β-lactoglobulin: Multi-spectroscopies, thermodynamics, molecular docking, and molecular dynamics simulation
Pujun Xie, Xiang Wang, Yejun Deng, Caihong Zhang, Yuechao Zhang, Lixin Huang
Topics & Concepts
Molecular dynamicsChemistryDocking (animal)Covalent bondMechanism (biology)Computational chemistryOrganic chemistryPhysicsMedicineQuantum mechanicsNursingProtein Interaction Studies and Fluorescence AnalysisSurfactants and Colloidal SystemsProteins in Food Systems