Recent Developments on Protein–Ligand Interactions From Structure, Function to Applications


English[eng]

9783040000000


pimaricin thioesterase||protein-substrate interaction||macrocyclization||molecular dynamics (MD) simulation||pre-reaction state||folate||folate receptor||peptide conjugation||click reaction||biolayer interferometry||acetylcholinesterase||resistance||organophosphorus||pesticides||molecular modeling||lepidopterous||insects||conserved patterns||similarity||3D-patterns||epigenetics||protein-RNA interaction||RRM domain inhibitor||NMR fragment-based screening||TDP-43||galectin-1||gulopyranosides||fluorescence polarization||benzamide||selective||phospholipase C gamma 1||SLP76||virtual screening||pharmacophore mapping||molecular docking||molecular dynamics||caspase inhibition||protein-ligand binding free energy||Monte Carlo sampling||docking and scoring||molecular conformational sampling||procollagen C-proteinase enhancer-1||glycosaminoglycans||computational analysis of protein-glycosaminoglycan interactions||calcium ions||fragment-based docking||protein–ligand analysis||drug discovery and design||structure–activity relationships||bioremediation||High Energy Molecules||HMX||protein design||nitroreductase||flavoprotein||substrate specificity||pharmacophore||secretoglobin||odorant-binding protein||chemical communication||pheromone||N-phenyl-1-naphthylamine||in silico docking||protein–ligand interactions||2D interaction maps||ligand-binding assays||protein-ligand complexes||dataset||clustering||structural alignment||refinement||PD-1/PD-L1||immune checkpoint inhibitors||biphenyl-conjugated bromotyrosine||amino acid conjugation||amino-X||in silico simulation||IC50