Chemical Data Lab

The research group focuses on chemical data in the context of biological systems. The investigated areas include structural bioinformatics of proteins and the application of computational methods of molecular modeling for designing the structural activity of new small molecules for specific biological effects.Another focus of the group is the development and operation of chemical databases and tools. The MolMeDB database collects physicochemical data on interactions of small molecules with membranes (https://molmedb.upol.cz/). The ChannelsDB database and the MOLEonline tool are dedicated to studying tunnels in proteins (https://mole.upol.cz/).