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Mendeleev Communications, 2023, Volume 33, Issue 3, Pages 419–421
DOI: https://doi.org/10.1016/j.mencom.2023.04.038
(Mi mendc415)
 

This article is cited in 6 scientific papers (total in 6 papers)

Communications

An efficient method of searching for correlations between unlimited datasets to provide forecasting models

A. Yu. Tolbin

Institute of Physiologically Active Compounds, Federal Research Center of Problems of Chemical Physics and Medicinal Chemistry, Russian Academy of Sciences, Chernogolovka, Moscow Region, Russian Federation
Abstract: This work presents a highly powerful and very simple statistical method for creating predictive models based on structure–property relationships. The algorithm was implemented in the software CORRELATO, which demo version is presented in Online Supplementary Materials. This algorithm was tested on a small series of phthalocyanine dyes to search for the relationship between optical limiting effect and quantum chemical descriptors responsible for the nonlinear optical properties of these absorbers
Keywords: correlations, phthalocyanine, J-dimers, optical limiting, forecasting models.
Bibliographic databases:
Document Type: Article
Language: English
Supplementary materials:
Supplementary_data_1.pdf (369.2 Kb)


Citation: A. Yu. Tolbin, “An efficient method of searching for correlations between unlimited datasets to provide forecasting models”, Mendeleev Commun., 33:3 (2023), 419–421
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  • https://www.mathnet.ru/eng/mendc/v33/i3/p419
  • This publication is cited in the following 6 articles:
    Citing articles in Google Scholar: Russian citations, English citations
    Related articles in Google Scholar: Russian articles, English articles
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