Computational modeling plays a pivotal role in glycosylation analysis by enabling the prediction and visualization of glycan-antibody interactions without the need for extensive laboratory work. This involves:
Predictive Modeling: Uses algorithms to predict potential glycan structures based on known data and biological context.
Molecular Dynamics Simulations: Allows researchers to visualize how glycan structures affect the conformation of the antibody over time.
Data Integration: Combines experimental data (like from MS) with computational data to create a more holistic view of glycosylation patterns.