Cheminformatics Libraries

PubChemPy provides a way to interact with PubChem in Python. It allows chemical searches by name, substructure and similarity, chemical standardization, conversion between chemical file formats, depi…

This is the only official Python client library developed and supported by ChEMBL group. The library helps accessing ChEMBL data and cheminformatics tools from Python. You don't need to know how to w…