Evaluation of the Reax Force-Field for Studying the Collision of an Energetic Proton with the DNA

Keyphrases

• Charge Equilibration 20%
• Collision Processes 20%
• Cytosine 20%
• DNA Damage 20%
• Energetic Protons 100%
• Energy Terms 20%
• Equilibration Method 20%
• Field Angle 20%
• Force Field 100%
• Genetic Algorithm 20%
• Guanine Base 20%
• Interaction Potential 40%
• Ionizing Particle 20%
• Ionizing Radiation 20%
• Particle Transfer 20%
• Phosphorus-nitrogen 20%
• Proton 100%
• Quantum Calculations 20%
• ReaxFF Potential 40%
• Scattering Angle 40%
• Surrounding Medium 20%
• Time-dependent Density Functional Theory 20%
• Time-dependent Density Functional Theory Calculation 20%
• Transferred Energy 20%
• Van Der Waals Energy 20%

Chemistry

• Carbon Atom 25%
• Cytosine 25%
• DNA 100%
• Energetics 100%
• Energy Transfer 25%
• Guanine 25%
• Hydrogen Atom 25%
• Ionizing Radiation 25%
• Pair-Base 25%
• Time-Dependent Density Functional Theory 50%