Automated design of ligands to polypharmacological profiles
作者： Jérémy Besnard , Gian Filippo Ruda , Vincent Setola , Keren Abecassis , Ramona M. Rodriguiz
DOI: 10.1038/NATURE11691
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摘要: The clinical efficacy and safety of a drug is determined by its activity profile across many proteins in the proteome. However, designing drugs with a specific multi-target profile is both …
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