2D interaction maps 3D-patterns Biochemistry Biology, life sciences HMX High Energy Molecules IC50 Monte Carlo sampling N-phenyl-1-naphthylamine NMR fragment-based screening PD-1/PD-L1 RRM domain inhibitor Research & information: general SLP76 TDP-43 acetylcholinesterase amino acid conjugation amino-X benzamide biolayer interferometry bioremediation biphenyl-conjugated bromotyrosine calcium ions caspase inhibition chemical communication click reaction clustering computational analysis of protein-glycosaminoglycan interactions conserved patterns dataset