molecular-fingerprints
A Python wrapper for PaDEL-Descriptor software
a *biosynformatic* fingerprint to explore natural product distance and diversity
Python wrapper for alvaDesc software
A cheminformatics package to perform Applicability Domain of molecular fingerprints based in similarity calculation.
Python wrapper for PaDEL-Descriptor, enabling fast calculation of molecular descriptors and fingerprints from RDKit molecules, with results as pandas DataFrames.
