Computational Chemistry

StructureResearch AreasComputational Chemistry

Computational Chemistry uses quantum chemistry and molecular simulation to forecast the structure, reactivity, and properties of organic and bioorganic molecules.

The team of Prof. P.Hobza as a Distinguished Chair was estabilished at the special position in the IOCB structure, but its research subject is also a part of the Computational Chemistry area...

 

Research Teams in Area of Computational Chemistry