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GrzybowskiBartosz Andrzej

Grzybowski, Bartosz A.
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Parallel Optimization of Synthetic Pathways within the Network of Organic Chemistry

Author(s)
Kowalik, MikolajGothard, Chris M.Drews, Aaron M.Gothard, Nosheen A.Weckiewicz, AlexFuller, Patrick E.Grzybowski, Bartosz A.Bishop, Kyle J. M.
Issued Date
2012-08
DOI
10.1002/anie.201202209
URI
https://scholarworks.unist.ac.kr/handle/201301/33127
Fulltext
https://onlinelibrary.wiley.com/doi/full/10.1002/anie.201202209
Citation
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, v.51, no.32, pp.7928 - 7932
Abstract
Finding a needle in a haystack : The number of possible synthetic pathways leading to the desired target of a synthesis can be astronomical (1019 within five synthetic steps). Algorithms are described that navigate through the entire known chemical‐synthetic knowledge to identify optimal synthetic pathways. Examples are provided to illustrate single‐target optimization and parallel optimization of syntheses leading to multiple targets.
Publisher
WILEY-V C H VERLAG GMBH
ISSN
1433-7851
Keyword (Author)
algorithmschemical networksoptimizationsynthetic methods

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