Post #2745461
2025-09-24 14:17 UTC
@dalke released chemfp 5.0, a Python package for cheminformatics fingerprint generation, search, and analysis, with support for CDK fingerprints
You can install it on Linux-based OSes using:
python -m pip install chemfp -i https://chemfp.com/packages/
For more details see https://chemfp.com/docs/whats_new_in_50.html#cdk
#chemistry #python
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