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. 2020 Oct 19;21(20):7738. doi: 10.3390/ijms21207738
%Ees+ct Percentage share of polar character of interaction according to PIEDA analysis
%MPE Percent of the maximal possible effect
ACN Acetonitrile
AUC Area under the curve
CCK Cholecystokinin
DALDA [d-Arg2, Lys4]-Dermorphin-(1-4)-amide
DAMGO [d-Ala2, N-Me-Phe4, Gly5-ol]-Enkephalin
DCC N,N′-dicyclohexylcarbodiimide
DCU N,N′-dicyclohexylourea
Dmt 2′,6′-Dimethyl-l-tyrosine
DMF Dimethylformamide
DOR δ-Opioid receptor
Ect Change-transfer contribution to PIE
Edisp Dispersion contribution to PIE
Eex Exchange repulsion contribution to PIE
Ees Electrostatic contribution to PIE
ESI-MS Electrospray-ionization mass spectrometry
Esolv Gibbs solution energy
FA Formic acid
FMO Fragment molecular orbital
GAMESS General Atomic and Molecular Electronic Structure System
GTPγS Guanosine 5′-O-[γ-thio]triphosphate
HOSu N-Hydroxysuccinimide
HPLC High performance liquid chromatography
IC50 Half-maximal inhibitory concentration
Ki Inhibition constant
Ki-67 Ki-67 protein
MD Molecular dynamics
MEM Minimal Essential Medium
MF Morphine
MOR μ-Opioid receptor
MTT 3-(4,5-Dimethylthiazol-2-yl)-2,5-diphenyltetrazolium bromide
NK1R Neurokinin-1 receptor
OPM Orientation of Proteins in Membrane Database
PIE Pair interaction energy
PIEDA Pair interaction energy decomposition analysis
POPC Phosphatidylcholine
R Correlation coefficient
RMSD Root mean square deviation
RP-HPLC Reversed-phase high performance liquid chromatography
SP Substance P
TFA Trifluoroacetic acid
TLC Thin layer chromatography
TM Transmembrane helix
TMG 1,1,3,3-Tetramethylguanidine
VGCC Voltage gated calcium channel