Projects in Awesome Lists tagged with ecfp4
A curated list of projects in awesome lists tagged with ecfp4 .
https://github.com/unixjunkie/consent
ligand-based virtual screening with consensus queries
chemical chemoinformatics consensus ecfp4 fingerprint lbvs ligand maccs molprint2d ocaml
Last synced: 14 Apr 2025
https://github.com/unixjunkie/mol2ecfp4
convert molecules to their ECFP4 fingerprint using rdkit
ecfp4 mol2 python-script rdkit sdf
Last synced: 14 Apr 2025
https://github.com/lhm30/scikitlearn_clustermap_rdkit_bicluster_molecules
hacked code to bicluster molecules using rdkit and scikitlearn
biclustering cheminformatics circular-fingerprints clustering ecfp-4 ecfp4 molecular-fingerprints molecular-similarity molecules rdkit scikit scikit-learn similarity smiles
Last synced: 15 Mar 2025
