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Algorithm for Reaction Classification

Published:2013-10-25 Issue:11 Volume:53 Page:2884-2895
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Kraut Hans¹,Eiblmaier Josef¹,Grethe Guenter²,Löw Peter¹,Matuszczyk Heinz¹,Saller Heinz¹

Affiliation:

1. InfoChem GmbH, Landsberger Strasse 408/V, D-81241, Munich, Bavaria, Germany

2. 352 Channing Way, Alameda, California 94502-7409, United States

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci400442f

Reference87 articles.

1. Classification of chemical reactions: potential, possibilities and continuing relevance

Cited by 48 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Spaces of mathematical chemistry;Theory in Biosciences;2024-09-11

2. Molecular representations in bio-cheminformatics;Memetic Computing;2024-07-20

3. Data Analytics for Catalysis Predictions: Are We Ready Yet?;ACS Catalysis;2024-05-08

4. Creating a Reaction Data Set Labeled with Reaction Class for Automated Reaction Classification for ReaxFF Molecular Dynamics Simulations of Realistic Fuel Pyrolysis;Energy & Fuels;2024-02-08

5. SynCluster: Reaction Type Clustering and Recommendation Framework for Synthesis Planning;JACS Au;2023-11-17

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