The official sources for the RDKit library

A powerful cheminformatics and molecule rendering toolbelt for JavaScript, powered by RDKit .

The RDKit nodes for the KNIME Analytics Platform

2025 RDKit UGM

KNIME nodes for working with lwreg

Updated version of Silicos-it's shape-based alignment tool

LaplacianNB is a Python module developed at Novartis AG for Naive Bayes classifier for laplacian modified models based on scikit-learn Naive Bayes implementation.

A package to identify matched molecular pairs and use them to predict property changes.