ABOUT US
In our lab we are integrated in multidisciplinary projects centered on two major themes for which we established a network of international and national collaborations, both experimental and theoretical. In fact, we lead teams of geographically distributed researchers (Bonn U, Medipol U, Weill Cornell M, Mount Sinai, Utrecht U, IST – Lisbon U, CMAT, INESC and LQAV from Porto U, CNC at UC) with very diverse scientific backgrounds to work at the interface of Computer Science and Structural Biology.
THE GROUP IN NUMBERS
Indexed Publications
Book Chapters
Conference Proceedings
NEWS
20 million CPU hours by PRACE Research Infrastructure within a collaboration with Nicolas Floquet’ Lab
We have been granted 20 million CPU hours by PRACE (Team members) within a collaboration with Floquet’s lab on Molecular Simulation to analyze conformational dynamics,
Our paper on IJMS has reached more than 2000 views
Our paper, “A Machine Learning Approach for Hot-Spot Detection at Protein-Protein Interfaces”, by Rita Melo et al., featuring a novel way to spot Hot-Spots using
4 million CPU hours by SURFsara HPC within a collaboration with Bonvin’s Lab
We have been granted 4 million CPU hours by SURFsara HPC within a collaboration with Bonvin’s lab on Molecular Simulation to understand crucial mechanistic features