Molecular fingerprints represent molecules by bit strings and belong to the most frequently used, most central methods of cheminformatics. They form the backbone for fast access to molecules in databases, machine learning with molecules and many tools based on topological molecular similarity.
CSFP - A New Molecular Fingerprint
The Concept of Partial Shape Similarity
The Concept of Partial Shape Similarity
Squeezed Me? Berry Nearly.
Squeezed Me? Berry Nearly.
Fingerprint Generation — Toolkits -- Cpp
EDIAScorer Tool Now Available
Development of Natural Compound Molecular Fingerprint (NC-MFP
Effectiveness of molecular fingerprints for exploring the chemical space of natural products, Theoretical and Computational Chemistry, ChemRxiv
PDF) Identification of Lignin and Polysaccharide Modifications in Populus Wood by Chemometric Analysis of 2D NMR Spectra from Dissolved Cell Walls
Molecular Fingerprint Screening in Trillion-Sized Chemical Spaces
Molecular Fingerprinting in Forensics: Solving Mysteries. - Nyayags
