T. R. Moharana

This study uses molecular dynamics simulations to show that water promotes folding of hydrophobic peptides into β-hairpin structures, while DMSO does not denature them but prevents folding from extended conformations.

This study investigates how stabilizing mutations in Bacillus subtilis lipase affect protein dynamics and stability, finding that enhanced dynamics in certain regions can improve overall stability without reducing activity.

This study improves lipase selectivity for omega-3 fatty acids through computational-guided mutagenesis and structural modifications.