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"LibINVENT: Reaction-based Generative Scaffold Decoration for in ..."
Vendy Fialková et al. (2022)
- Vendy Fialková, Jiaxi Zhao, Kostas Papadopoulos, Ola Engkvist, Esben Jannik Bjerrum, Thierry Kogej, Atanas Patronov:
LibINVENT: Reaction-based Generative Scaffold Decoration for in Silico Library Design. J. Chem. Inf. Model. 62(9): 2046-2063 (2022)
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