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Finding the K best synthesis plans
In synthesis planning, the goal is to synthesize a target molecule from available starting materials, possibly optimizing costs such as price or environmental impact of the process. Current algorithmic approaches to synthesis planning are usually based on selecting a bond set and finding a single go...
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| Publié dans: | J Cheminform |
|---|---|
| Auteurs principaux: | , , , , |
| Format: | Artigo |
| Langue: | Inglês |
| Publié: |
Springer International Publishing
2018
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| Sujets: | |
| Accès en ligne: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5887019/ https://ncbi.nlm.nih.gov/pubmed/29623440 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-018-0273-z |
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