## Abstract Similarity networks of ligands are often reported useful in predicting chemical activities and target proteins. However, the naive method of computing all pairwise similarities of chemical fingerprints takes quadratic time, which is prohibitive for large scale databases with millions of
✦ LIBER ✦
Molecular Fingerprint Recombination: Generating Hybrid Fingerprints for Similarity Searching from Different Fingerprint Types
✍ Scribed by Britta Nisius; Jürgen Bajorath
- Book ID
- 102104284
- Publisher
- John Wiley and Sons
- Year
- 2009
- Tongue
- English
- Weight
- 445 KB
- Volume
- 4
- Category
- Article
- ISSN
- 1860-7179
No coin nor oath required. For personal study only.
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## Abstract Fingerprints are bit string representations of molecular structure and properties and are among the most widely used computational tools for similarity searching and database screening. Various fingerprint designs are available and their search performance is in general strongly depende
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