A quantum mechanical investigation of possible mechanisms for the nucleotidyl transfer reaction catalyzed by DNA polymerase β

Keyphrases

• Mechanical Investigation 100%
• Aspartic 50%
• Protonation 50%
• Exothermic Process 25%
• Mechanical Quantum 25%
• Quantum Mechanical Methods 25%
• Pentavalent 25%
• Quantum Hybrid 25%
• Crystal Water 25%
• B3LYP/6-31G(d,p) 25%
• Adjacent Water 25%
• Mechanical Studies 25%
• Kinetic Cycle 25%
• Dominant Pathways 25%
• Hybrid Quantum 25%
• Associative Mechanism 25%
• Protein Effect 25%

Chemistry

• DFT-B3LYP Calculation 20%
• Exothermic Process 20%
• Calorific Value 20%
• Quantum Mechanical Method 20%

Biochemistry, Genetics and Molecular Biology

• Protonation 40%