Automatic Extraction of Reaction Templates for Synthesis Prediction

Several tools for the computational planning of synthetic routes have been developed over the last 60 years. Traditionally these have been built on manually or automatically extracted reaction rules or templates obtained from a deep knowledge of organic chemistry in the case of the former, and reac...

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Bibliographic Details
Main Authors: Amol Thakkar, Jean-Louis Reymond
Format: Article
Language:deu
Published: Swiss Chemical Society 2022-04-01
Series:CHIMIA
Subjects:
Online Access:https://chimia.ch/chimia/article/view/5893