Exploration of human serum albumin binding sites by docking and molecular dynamics flexible ligand - Protein interactions

Chemistry

• Molecular Dynamics 52%
• Binding Site 50%
• QSAR Study 49%
• Simulation 45%
• Warfarin 31%
• Ketoprofen 30%
• Calorific Value 25%
• Protein Structure 23%
• Ligand 20%
• Flexibility 18%
• Kd 18%
• Gibbs Free Energy 17%
• Drug 12%
• Protein 9%

Engineering & Materials Science

• Binding sites 100%
• Ligands 94%
• Molecular dynamics 80%
• Proteins 65%
• Conformations 12%
• Free energy 12%
• Computer simulation 11%
• Regression analysis 10%

Medicine & Life Sciences

• Human Serum Albumin 84%
• Molecular Dynamics Simulation 79%
• Binding Sites 55%
• Ligands 50%
• Proteins 26%
• Quantitative Structure-Activity Relationship 21%
• Ketoprofen 10%
• Warfarin 8%
• Regression Analysis 5%
• Pharmaceutical Preparations 3%