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Automatic retrosynthetic route planning using template-free models
Retrosynthetic route planning can be considered a rule-based reasoning procedure. The possibilities for each transformation are generated based on collected reaction rules, and then potential reaction routes are recommended by various optimization algorithms. Although there has been much progress in...
Autores principales: | Lin, Kangjie, Xu, Youjun, Pei, Jianfeng, Lai, Luhua |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8152431/ https://www.ncbi.nlm.nih.gov/pubmed/34122843 http://dx.doi.org/10.1039/c9sc03666k |
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