Now showing items 1-6 of 6

    • Adaptive on-the-fly molecular ribbons generation 

      Hermosilla, Pedro; Guallar, Víctor; Vinacua Pla, Álvaro; Vázquez Alcocer, Pere Pau (European Association for Computer Graphics (Eurographics), 2015)
      Conference lecture
      Open Access
      Molecular dynamics simulations are of key importance in the drug design field. One common used representation to visualize these simulations is the Ribbons representation, which gives to the expert a good overview of the ...
    • Instant visualization of secondary structures of molecular models 

      Hermosilla, Pedro; Guallar, Víctor; Vinacua Pla, Álvaro; Vázquez Alcocer, Pere Pau (European Association for Computer Graphics (Eurographics), 2015)
      Conference report
      Open Access
      Molecular Dynamics simulations are of key importance in the drug design field. Among all possible representations commonly used to inspect these simulations, Ribbons has the advantage of giving the expert a good overview ...
    • Interactive GPU-based generation of solvent-excluded surfaces 

      Hermosilla, Pedro; Krone, Michael; Guallar, Victor; Vázquez, Pere-Pau; Vinacua Pla, Álvaro; Ropinski, Timo (Springer International Publishing, 2017-06)
      Article
      Open Access
      The solvent-excluded surface (SES) is a popular molecular representation that gives the boundary of the molecular volume with respect to a specific solvent. SESs depict which areas of a molecule are accessible by a specific ...
    • Physics-Based Visual Characterization of Molecular Interaction Forces 

      Hermosilla, Pedro; Estrada, Jorge; Guallar, Victor; Ropinski, Timo; Vinacua, Álvar; Vázquez, Pere-Pau (IEEE, 2017-01)
      Article
      Open Access
      Molecular design procedures, such as drug design and protein engineering’ are complex processes, largely benefiting from computational resources but also from human analysis. In drug design, for example, a costly iterative ...
    • Physics-based visual characterization of molecular interaction forces 

      Hermosilla, Pedro; Estrada, Jorge; Guallar, Víctor; Ropinski, Timo; Vinacua Pla, Álvaro; Vázquez Alcocer, Pere Pau (2017-01-01)
      Article
      Open Access
      Molecular simulations are used in many areas of biotechnology, such as drug design and enzyme engineering. Despite the development of automatic computational protocols, analysis of molecular interactions is still a major ...
    • Single pass GPU stylized edges 

      Hermosilla, Pedro; Vázquez Alcocer, Pere Pau (2009)
      Conference report
      Restricted access - publisher's policy
      Silhouette detection is a key issue in many non-photorealistic rendering algorithms. Silhouettes play an important role in shape recognition because they provide one of the main cues for figure-to-ground distinction. ...