Molecular modeling of σ1 receptor ligands: A model of binding conformational and electrostatic considerations

Engineering & Materials Science

• Molecular modeling 100%
• Ligands 87%
• Electrostatics 70%
• Binding sites 30%
• Atoms 22%
• Hydrogen bonds 15%
• Molecules 10%
• Sulfur 10%
• Nitrogen 10%
• Oxygen 8%
• Carbon 8%

Physics & Astronomy

• ligands 66%
• electrostatics 50%
• nitrogen atoms 12%
• centroids 12%
• hydrogen bonds 11%
• oxygen atoms 11%
• drugs 11%
• sulfur 10%
• selectivity 10%
• synthesis 7%
• rings 7%
• carbon 7%
• molecules 5%
• atoms 5%
• interactions 4%

Chemical Compounds

• Molecular Modeling 59%
• Ligand 28%
• Pentazocine 21%
• Binding Site 18%
• Haloperidol 18%
• Sulfur Atom 12%
• Aromatic Structure 11%
• Nitrogen Atom 11%
• Oxygen Atom 10%
• Hydrogen Bond 8%
• Drug 6%
• Carbon Atom 6%
• Molecule 4%