ABEEM Solver

Calculates partial atomic charges for small organic molecules, drug-like molecules.

pyChemInf

Lite chemoinformatics framework in Python.

AtomicChargeCalculator

A web application for the calculation and analysis of atomic charges in both large biomolecular complexes and small drug-like molecules.

P2Rank

Novel machine learning-based method for prediction of ligand binding sites from protein structure.

IDSM

Integrated Database of Small Molecules