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This article is cited in 46 scientific papers (total in 46 papers)
Artificial intelligence in synthetic chemistry: achievements and prospects
I. I. Baskinab, T. I. Madzhidovb, I. S. Antipinb, A. A. Varnekbc a Lomonosov Moscow State University, Faculty of Physics
b Kazan State University A. Butlerov, Institute of Chemistry
c Laboratory of Chemoinformatics (UMR 7140 CNRS/UniStra), University of Strasbourg, France
Abstract:
The review is devoted to the achievements in analysis of information on chemical reactions using machine learning methods. Four large areas that actively use these methods are outlined: computer-assisted planning of synthesis, analysis and visualization of chemical reaction data, prediction of the quantitative characteristics of reactions and computer-aided design of catalysts. The bibliography includes 346 references.
Received: 14.04.2017
Citation:
I. I. Baskin, T. I. Madzhidov, I. S. Antipin, A. A. Varnek, “Artificial intelligence in synthetic chemistry: achievements and prospects”, Usp. Khim., 86:11 (2017), 1127–1156; Russian Chem. Reviews, 86:11 (2017), 1127–1156
Linking options:
https://www.mathnet.ru/eng/rcr4189https://doi.org/10.1070/RCR4746 https://www.mathnet.ru/eng/rcr/v86/i11/p1127
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