Dynamic and thermodynamic impact of L94A, W100A, and W100L mutations on the D2 dopamine receptor bound to risperidone

Engineering & Materials Science

• Dopamine 97%
• Ligands 84%
• Molecular recognition 72%
• Thermodynamics 54%
• Molecular dynamics 47%
• Phospholipids 34%
• Molecular mechanics 33%
• Binding sites 29%
• Conformations 26%
• Free energy 25%
• Computer simulation 23%
• Principal component analysis 19%

Chemistry

• Risperidone 100%
• Dopamine 59%
• Mutation 53%
• Thermodynamics 39%
• Molecular Recognition 25%
• Simulation 24%
• Molecular Dynamics 18%
• Neuroleptic Agent 17%
• Residence Time 13%
• Molecular Mechanic 12%
• Phospholipid 10%
• Compound Mobility 9%
• Gibbs Free Energy 9%
• Surface Area 8%
• Crystal Structure 6%
• Ligand 5%
• Time 4%