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Conformations article 42 priority journal 42 Molecular structure 28 unclassified drug 26 chemistry 22 nonhuman 20 protein conformation 20 Chemical bonds 18 Models, Molecular 18 Proteins 18 metabolism 18 Hydrogen bonds 16 Molecular dynamics 16 chemical structure 16 conformational transition 16 Amino acids 14 Density functional theory 14 Humans 14 Ligands 14 Nuclear magnetic resonance spectroscopy 14 Protein Conformation 14 Thermodynamics 14 controlled study 14 Aromatic compounds 12 Article 12 Conformational analysis 12 Crystal structure 12 X ray crystallography 12 conformation 12