About Me
A Computational Chemist, experienced in probing and providing structural and dynamical insights into the fundamental processes in biology using atomistic molecular modeling and simulations. Contributed to the several areas of Biophysical Chemistry and Structural Biology, e.g. protein folding, misfolding and aggregation; protein denaturation under various perturbing conditions; protein folding rate prediction and characterisation of protein unfolded ensemble; single molecule dynamics and mechanical properties of single protein molecules. Recently worked on intrinsically disordered proteins - a fast emerging area of protein structure-function-dynamics characterisation. Currently working on - identification of misfolding-prone epitopes, prediction of clinical observables of neurodegenerative diseases, characterisation of conformation landscape of oligomers, identification of aggregation kinetics, and rational designing of conjugate peptide-based drugs.