Works cited by this work

43 works

Work: QSAR-modeling of toxicity of organometallic compounds by means of the balance of correlations for InChI-based optimal descriptors

1. Prediction of the glass transition temperature of (meth)acrylic polymers containing phenyl groups by recursive neural network

   ‪Carlo Bertinetto‬, Celia Duce, Alessio Micheli +3

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   ABIABI:AkademIndex/openalex/2026.other.105539

2. Comparative QSAR Studies of CYP1A2 Inhibitor Flavonoids Using 2D and 3D Descriptors

   Kunal Roy, Partha Pratim Roy

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   ABIABI:AkademIndex/openalex/2026.other.166501

3. Enhancement of the chemical semantic web through the use of InChI identifiers

   Simon J. Coles, Nick Day, Peter Murray‐Rust +2

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   ABIABI:AkademIndex/openalex/2026.other.171561

4. QSAR Modeling of Acute Toxicity for Nitrobenzene Derivatives Towards Rats: Comparative Analysis by MLRA and Optimal Descriptors

   Andrey A. Toropov, Bakhtiyor Rasulev, Jerzy Leszczyński

   Article20072 citations

   ABIABI:AkademIndex/openalex/2026.other.355731

5. A Novel RBF Neural Network Training Methodology to Predict Toxicity to Vibrio Fischeri

   Georgia Melagraki, Antreas Afantitis, Haralambos Sarimveis +2

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   ABIABI:AkademIndex/openalex/2026.other.355734

6. Comparison of QSPR Models Based on Hydrogen-Filled Graphs and on Graphs of Atomic Orbitals

   Andrey A. Toropov, Alla P. Toropova, İvan Gutman

   ArticleComputational Drug Discovery MethodsUniversity of Zagreb University Computing Centre (SRCE)20052 citations

   ABIABI:AkademIndex/openalex/2026.other.355741

7. QSPR modeling of the formation constants for complexes using atomic orbital graphs

   Andrey A. Toropov, Alla P. Toropova

   Article20002 citations

   ABIABI:AkademIndex/openalex/2026.other.355742

8. QSPR modeling of the stability constants of biometal complexes with phosphate derivatives of adenosine

   Andrey A. Toropov, Alla P. Toropova

   Article20002 citations

   ABIABI:AkademIndex/openalex/2026.other.355743

9. Structure-toxicity relationships of nitroaromatic compounds

   Olexandr Isayev, Bakhtiyor Rasulev, Leonid Gorb +1

   ArticleComputational Drug Discovery MethodsMolecular Diversity20061 citations

   ABIABI:AkademIndex/openalex/2006.article.000017

10. Additive SMILES-based optimal descriptors in QSAR modelling bee toxicity: Using rare SMILES attributes to define the applicability domain

    Andrey A. Toropov, Emilio Benfenati

    ArticleComputational Drug Discovery MethodsBioorganic & Medicinal Chemistry20081 citations

    ABIABI:AkademIndex/openalex/2008.article.000042

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    ABIABI:AkademIndex/openalex/2026.other.355725

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    ABIABI:AkademIndex/openalex/2026.other.355726

13. Nearest neighboring code and hydrogen bond index in labeled hydrogen-filled graph and graph of atomic orbitals: application to model of normal boiling points of haloalkanes

    Andrey A. Toropov, Alla P. Toropova

    ArticleComputational Drug Discovery MethodsJournal of Molecular Structure THEOCHEM20041 citations

    ABIABI:AkademIndex/openalex/2026.other.355727

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    ABIABI:AkademIndex/openalex/2026.other.355732

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    ABIABI:AkademIndex/openalex/2026.other.355744