Best Poster Award at SMCB-2024
I am a theoretical and computational chemist working at the interface of chemistry and biophysics. The primary focus of my research comprises understanding the role of non-covalent interactions in aqueous-osmolyte and protein-osmolyte interactions in ambient and extreme thermodynamic conditions. I am interested in using data-driven ML-based approaches to develop MLIPs and explore biomolecular interactions, solvation, structure, dynamics, and thermodynamics. Additionally, I am also interested in water and ion permeation in various nanoconfinements. Molecular dynamics simulations and statistical mechanics form the backbone of my research.
"An equation means nothing to me unless it expresses a thought of God."
Srinivasa Ramanujan