Artificial neural networks for drug discovery
Machine learning in the drug discovery pipeline
In the last years, Acellera has been developing machine learning based tools, gathering experience and earning expertise in this field. Some of these tools have been published in the scientific literature and are freely available at Playmolecule. We believe that machine learning techniques can accelerate the drug discovery process by identifying binding pockets, selecting better candidates, excluding toxic or reactive molecules and improving the ADMET profile of the selected agents.