Simulation of interaction of farmacologically active compounds with models of cyclodextrin based nanosponges
Theoretical modelling of melatonin and curcumin with beta-cyclodextrin, binding energy distribution and simulation of IR spectra. The project is developed in conjuction with the Polymeric Material Groups of UniTO
Our publications: pure cyclodextrin DFT, Melatonin/beta-cyclodextrin interaction, Melatonin/nanosponge transdermal delivery