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The Molecular Modelling group studies mechanisms of molecular recognition, in particular protein-protein or protein-small ligand interactions. The group develops and employs molecular modelling techniques such as homology, molecular dynamics, docking and free energy simulations. Most efforts are concentrated on the development of new small molecule inhibitors of important targets for cancer therapy, as well as the design of optimized peptides vaccines or T Cell Receptor (TCR) sequences for cancer immunotherapy.


Molecular Modelling Group Projects


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