Rényi's divergence as a chemical similarity criterion

DOI10.1007/s10910-021-01307-6zbMath1481.92189OpenAlexW3215707568MaRDI QIDQ2072229

Nelson Flores-Gallegos

Publication date: 26 January 2022

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-021-01307-6

zbMATH Keywords

Rényi's entropychemical similaritychemical reactivityRényi's divergence

Mathematics Subject Classification ID

Classical flows, reactions, etc. in chemistry (92E20) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Related Items (3)

On the information balance in a simple chemical process ⋮ An approach to Hammond's principle through Kullback-Leibler's entropy ⋮ An approach to local electron energy in atoms through Rényi's entropy

Uses Software

• GAUSSIAN

Cites Work

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• Rényi Divergence and Kullback-Leibler Divergence
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• Fisher information and Rényi entropies in dynamical systems
• On Information and Sufficiency

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