Information technologies

Information technologies

Biological database development and management

  • Customized databases tailored to specific projects
  • Full database management: update, data entry interfaces, query
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Database analysis

  • Protein validation as therapeutic target or diagnostic marker
  • Selection of putative protein ligands for drug discovery and drug development

Grid computing for structural biology

  • Structure determination of target protein and target-ligand complexes, rational molecular design, prediction of binding affinities
  • Molecular dynamics simulations to investigate the structure, dynamics, and thermodynamics of biological molecules and their complexes

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