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- W2087302012 abstract "Chemical similarity is a very popular method for virtual screening. Similarity methods have been under development for decades and there is a tendency for the newer methods to be more complex (and more computationally expensive). One stated justification for adding complexity is that the methods are better able to ‘lead-hop’. However, is this really true? I argue that only some types of complexity are useful in this regard." @default.
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- W2087302012 date "2007-04-01" @default.
- W2087302012 modified "2023-10-11" @default.
- W2087302012 title "Chemical similarity searches: when is complexity justified?" @default.
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- W2087302012 doi "https://doi.org/10.1517/17460441.2.4.423" @default.
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