Now showing items 1-2 of 2

    • Interactive CPU-based Ray Tracing of Solvent Excluded Surfaces 

      Rau, Tobias; Zahn, Sebastian; Krone, Michael; Reina, Guido; Ertl, Thomas (The Eurographics Association, 2019)
      Depictions of molecular surfaces such as the Solvent Excluded Surface (SES) can provide crucial insight into functional molecular properties, such as the molecule's potential to react. The interactive visualization of ...
    • Molecular Sombreros: Abstract Visualization of Binding Sites within Proteins 

      Schatz, Karsten; Krone, Michael; Bauer, Tabea L.; Ferrario, Valerio; Pleiss, Jürgen; Ertl, Thomas (The Eurographics Association, 2019)
      We present a novel abstract visualization for the binding sites of proteins. Binding sites play an essential role in enzymatic reactions and are, thus, often investigated in structural biology. They are typically located ...