Computational Bio/Nano Sciences
Research Interests
Keywords. Theoretical biophysics, structure and electronic properties of DNA and proteins, conformational flexibility and thermodynamics, charge transfer in biological systems, molecule/surface interactions, biomolecular nanostructures, protein-DNA binding, hybrid materials and bio-nano-systems, Density Functional Theory (DFT), Molecular Dynamics (MD), Quantum Computation applied to high-performance computational problems. Click here for specific topics.
DoE award DE-SC0019432 Q4Q: Quantum Computation for Quantum Prediction of Materials and Molecular Properties.
