Computational & Theoretical Chemistry

• biomolecular simulations
• density functional theory
• electrochemistry modeling
• molecular dynamics
• protein structural dynamics

Research Faculty:

• Martin Andrew Edwards – nanoelectrochemistry, mathematical modeling with physical/analytical techniques
• Dylan Girodat – biomolecular structure, dynamics, and kinetics
• Mahmoud Moradi – biomolecular simulations and protein structural dynamics
• Feng Wang – theory, simulations