Research Activities
The use of molecular modeling for detailed studies of the recognition and binding processes of macromolecules of biological and pharmacological interest.
Investigation, High Throughput Virtual Screening (HTVS), rational and de novo design, drug repurposing, and iterative optimization of pharmacologically active molecules and other therapeutic entities (like small molecules and RNAs) aimed at treating or preventing pathological conditions in living organisms.
The study of protein variants, mutations, and post-translational modifications using molecular modelling methods.
Employment of deep learning methods for protein design and engineering
Deployment and application of automated analysis pipelines for the analysis of bulk, single-cell and spatial transcriptomics data.






