- Studying biomolecules
by means of molecular modelling, structure determination and
- Developing program
packages for computer aided drug design (CADD) and conducting CADD for
the design of compounds and novel therapeutic agents.
- Application of
quantum mechanics and molecular mechanics for the simulation and study
of structure, stability and reactivity of chemical species in the gas
phase and in solution.
organometallic catalysts for polymerization reactions.