Scientific offering

  • Catalyst design and optimization.
  • General molecular modeling.
  • Molecular dynamics/multiscale methods for the study of chemical/ biological systems or materials.
  • Prediction/optimization of spectroscopic properties.
  • Preparation of (a)chiral organic compounds. Characterization via spectroscopic techniques.
  • Preparation of synthetic receptors for relevant biomolecules. Applicability as chemical sensors
  • Study of reaction mechanisms for the optimization of chemical processes (lowering reaction barriers, achieving/enhancing regio or stereoselectivity, etc.)
  • Synthesis of lyotropic chiral liquid crystals with potential usage in NMR.