Stabbing balls and simplifying proteins

  • Authors:
  • Ovidiu Daescu;Jun Luo

  • Affiliations:
  • Department of Computer Science, University of Texas at Dallas, MS-EC 31, 2601 N. Floyd Rd., Richardson, TX 75080, USA.;Shenzhen Institute of Advanced Technology, Chinese Academy of Sciences, Shekou, Shenzhen, Zip 518067, China

  • Venue:
  • International Journal of Bioinformatics Research and Applications
  • Year:
  • 2009

Quantified Score

Hi-index 0.00

Visualization

Abstract

We address the problem of stabbing a sequence of indexed balls B= {B1,B2,..., Bn} inR3, where Bi (1 ≤i≤n) has centrepi and radius εi; a solution is anincreasing integer sequence i1,..., im suchthat i1 = 1, im = n and for ij≤ k ≤ ij+1 the line segment PijPij+1 stabs the ball Bk; the goal is tominimise m. The problem finds applications in simplification ofmolecule chains for visualisation, matching and efficient searchingin molecule and protein databases. We implemented the algorithm andcreated a web server where one can input a pdb file and get thesimplified protein chains. We did experiments on thousands ofproteins from the PDB Bank to estimate the simplification ratioachieved.