Watergate: Visual Exploration of Water Trajectories in Protein Dynamics Supplementary Material
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چکیده
To better demonstrate the usability of Watergate, the supplementary material contains the description the second case study conducted by the protein engineers. In order to better support the reproducibility of Watergate, we also provide the readers with details about the bandwidth matrix estimation used in our approach. We also measured the performance of the DensityIsosurface representation and we provide the comparison with other existing solutions.
منابع مشابه
Watergate: Visual Exploration of Water Trajectories in Protein Dynamics
The function of proteins is tightly related to their interactions with other molecules. The study of such interactions often requires to track the molecules that enter or exit specific regions of the proteins. This is investigated with molecular dynamics simulations, producing the trajectories of thousands of water molecules during hundreds of thousands of time steps. To ease the exploration of...
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تاریخ انتشار 2017