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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.
A Practical Introduction to the Use of Molecular Fingerprints in Drug Discovery, by Laksh
Molecular fingerprint-derived similarity measures for toxicological read-across: Recommendations for optimal use - ScienceDirect
Squeezed Me? Berry Nearly.
How to Search (Maximum Common) Substructures in 30 billion Compounds on a Laptop
How to Search (Maximum Common) Substructures in 30 billion Compounds on a Laptop
May-June, 2022 Vol, 28 No. 3 - Flip eBook Pages 1-50
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