Craig plot 2.0: an interactive navigation in the substituent bioisosteric space

Abstract Bioisosteric replacement is a standard technique that is used in medicinal chemistry to design analogs of bioactive molecules with similar biological activity and with additional improved characteristics. Successful application of this technique relies on a good knowledge of physicochemical...

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Bibliographic Details
Main Author: Peter Ertl
Format: Article
Language:English
Published: BMC 2020-01-01
Series:Journal of Cheminformatics
Subjects:
Online Access:https://doi.org/10.1186/s13321-020-0412-1