Screen
This category contains 18 nodes.
BCUT Streamable
BCUT descriptors.
Chemical Fingerprint Streamable
Chemical Fingerprint descriptors.
ECFP/FCFP Streamable
ECFP - Extended-Connectivity Fingerprints.
Maccs Fingerprint Streamable
Maccs Fingerprint descriptors.
MolSimilarity
Calculate the dissimilarity.
Pharmacophore Fingerprint Streamable
Pharmacophore Fingerprint descriptors.
Reaction Fingerprint Streamable
Reaction Fingerprint descriptors.
RxnSimilarity
Calculate the dissimilarity based on a Reaction Fingerprint.
Screen3D
Calculate the three dimensional similarity comparison of molecular pairs.