Theoretical Biophysical Chemistry

This session merges theory with biomolecular chemistry to explain structural and functional behaviors. Topics include protein folding, enzymatic pathways, and ligand–receptor interactions. Molecular dynamics simulations and free energy calculations will be highlighted. Attendees will learn about computational drug binding predictions and protein engineering. The role of water and solvent dynamics in biomolecular systems will be emphasized. Theoretical models for biomolecular spectroscopy will also be presented. This session demonstrates the power of theoretical chemistry in biological discoveries.

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