The official sources for the RDKit library
HTML2677bsd-3-clause
23 hours ago
c-plus-pluscheminformaticspython
RDKit wrapper
Python48other
7 months ago
Simple RDKit molecule editor GUI using PySide
Python119lgpl-3.0
4 months ago
Wrapper for RDKit's RunReactants to improve stereochemistry handling
Jupyter Notebook154mit
last year
A script to run structural alerts using the RDKit and ChEMBL
Python124mit
