Combination of molecular similarity measures using data fusion
β Scribed by Claire M.R. Ginn; Peter Willett; John Bradshaw
- Book ID
- 110267188
- Publisher
- Springer
- Year
- 2000
- Tongue
- English
- Weight
- 79 KB
- Volume
- 20
- Category
- Article
- ISSN
- 0928-2866
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Three-dimensional (3D)-database searches are now being widely applied to determine potential new active molecules. Many structural data sets obtained as a result of these searches are still large in size. In this paper we apply molecular similarity calculations as a rapid method to screen two such d
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