Data-Driven Molecular Design


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 with very diverse scientific backgrounds to work at the interface of Computer Science and Structural Biology.

The Group in Numbers


Euros - Funding

CPU hours - HPC funding


COST actions

We are happy to announce that we are now part of two COST actions: CA17104 – New diagnostic and therapeutic tools against multidrug resistant tumors CA18240 – ADHEsion GPCR Network: Research and Implementation Set the path for future Exploration

Christmas Celebrations 2018

At the Christmas party of the Data-Driven Molecular Design, most of the co-workers of our CNC lab were present, and we made a nice picture. From left to right: Carlos Barreto, António Gomes, Manuel Pires, Irina Moreira, Agostinho Lemos, Rita Melo, Joana Mourão, Pedro Filipe, Xavier Pinho and Ana Teresa Gaspar.

Contact us