The chapter reviews the application of diffusion maps and sketch-map to biomolecular MD trajectories, covering algorithm function, practical considerations, comparisons on sample data, sketch-map applications, and future directions.
Nguyen, and Gerhard Stock
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Using data-reduction techniques to analyse biomolecular trajectories
The chapter reviews the application of diffusion maps and sketch-map to biomolecular MD trajectories, covering algorithm function, practical considerations, comparisons on sample data, sketch-map applications, and future directions.