[Rdkit-discuss] Senior Bioinformatician - AstraZeneca (Cambridge, UK)

*Are you a quantitatively-minded scientist looking to apply bioinformatics and machine learning to design the next generation of therapeutics? Do you wish to join a growing team where you will have the possibility to further exploit our drug discovery platforms? If yes, we have the position for

[Rdkit-discuss] inter-classes Tanimoto similarity

Hi, I am trying to calculate the inter-classes Tanimoto similarity using RDkit fingerprints for several classes of GPCR ligands and provided the results in the form of a square matrix or a heatmap.I have attempted using the Bulktanimoto similarity function for that purpose, it works. I am