Immersive technologies like stereo rendering, virtual reality, or augmented reality (AR) are often used in the field of molecular visualisation. Modern, comparably lightweight and affordable AR headsets like Microsoft's HoloLens open up new possibilities for immersive analytics in molecular visualisation. A crucial factor for a comprehensive analysis of molecular data in AR is the rendering speed. HoloLens, however, has limited hardware capabilities due to requirements like battery life, fanless cooling and weight. Consequently, insights from best practises for powerful desktop hardware may not be transferable. Therefore, we evaluate the capabilities of the HoloLens hardware for modern, GPU-enabled, high-quality rendering methods for the space-filling model commonly used in molecular visualisation. We also assess the scalability for large molecular data sets. Based on the results, we discuss ideas and possibilities for immersive molecular analytics. Besides more obvious benefits like the stereoscopic rendering offered by the device, this specifically includes natural user interfaces that use physical navigation instead of the traditional virtual one. Furthermore, we consider different scenarios for such an immersive system, ranging from educational use to collaborative scenarios.
Several algorithms, approaches, and implementations have been developed to support comparison of scan paths and finding of interesting scan path structures. In this work we contribute a visual approach to support scan path comparison. A key feature of this approach is the combination of a clustering algorithm using Levenshtein distance with the parallel scan path visualization technique. The combination of computational methods with an interactive visualization allows us to use both the power of pattern finding algorithms and the human ability to visually recognize patterns. To use the concept in practice we implemented the approach in a prototype and show its application in two scan path analysis scenarios from automobile usability testing and visualization research.
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