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Andrey A. Toropov

Работ: 72

Uzbekistan Academy of Sciences Research Institute ‘Algorithm-Engineering', 700125 F. Khodjaeva Street 25, Tashkent, Uzbekistan, and Drug Theoretics and Cheminformatics Lab Division of Medicinal and Pharmaceutical Chemistry, Department of Pharmaceutical Technology, Jadavpur University, Kolkata 700 032, India

  1. QSPR Modeling of Lipid-Water Partition Coefficient by Optimization of Correlation Weights of Local Graph Invariants

    Andrey A. Toropov, Kunal Roy

    СтатьяComputational Drug Discovery MethodsJournal of Chemical Information and Computer Sciences2003Цитирований: 7
    ABI

  2. Applying the Monte Carlo technique to build up models of glass transition temperatures of diverse polymers

    Andrey A. Toropov, Alla P. Toropova, В. О. Кудышкин +2

    СтатьяAdsorption, diffusion, and thermodynamic properties of materialsStructural Chemistry2020Цитирований: 4
    ABI

  3. QSPR Modeling of Stability Constants of Coordination Compounds by Optimization of Correlation Weights of Local Graph Invariants

    Alla P. Toropova, Andrey A. Toropov, M. M. Ishankhodzhaeva +1

    СтатьяComputational Drug Discovery MethodsRussian Journal of Inorganic Chemistry2000Цитирований: 4
    ABI

  4. Quantitative structure-property relationships for binary polymer-solvent systems: Correlation weighing of the local invariants of molecular graphs

    Andrey A. Toropov, Н. Л. Воропаева, I. N. Ruban +1

    СтатьяChemical Thermodynamics and Molecular Structure1999Цитирований: 4
    ABI

  5. 3D weighting of molecular descriptors for QSPR/QSAR by the method of ideal symmetry (MIS). 1. Application to boiling points of alkanes

    Andrey A. Toropov, Alla P. Toropova, Т. Т. Исмаилов +1

    СтатьяComputational Drug Discovery MethodsJournal of Molecular Structure THEOCHEM1998Цитирований: 4
    ABI

  6. Simplified molecular input line entry system (SMILES) as an alternative for constructing quantitative structure-property relationships (QSPR)

    Andrey A. Toropov, Alla P. Toropova, Dilya V. Mukhamedzhanova +1

    СтатьяComputational Drug Discovery MethodsINDIAN JOURNAL OF CHEMISTRY- SECTION A2005Цитирований: 3
    ABI

  7. SMILES in QSPR/QSAR Modeling: Results and Perspectives

    Andrey A. Toropov, Emilio Benfenati

    СтатьяComputational Drug Discovery MethodsCurrent Drug Discovery Technologies2007Цитирований: 3
    ABI

  8. Prediction of the Q-e parameters from structures of transfer chain agents

    Alla P. Toropova, Andrey A. Toropov, В. О. Кудышкин +1

    СтатьяComputational Drug Discovery MethodsJournal of Polymer Research2015Цитирований: 3
    ABI

  9. Comparison of QSPR models of octanol/water partition coefficient for vitamins and non vitamins

    Ivan Raška, Andrey A. Toropov

    СтатьяComputational Drug Discovery MethodsEuropean Journal of Medicinal Chemistry2006Цитирований: 2
    ABI

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

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

    СтатьяComputational Drug Discovery MethodsUniversity of Zagreb University Computing Centre (SRCE)2005Цитирований: 2
    ABI

  11. Prediction of alkane enthalpies by means of correlation weighting of Morgan extended connectivity in molecular graphs

    Andrey A. Toropov, Alla P. Toropova, A.I. Nesterova +1

    СтатьяComputational Drug Discovery MethodsChemical Physics Letters2004Цитирований: 2
    ABI

  12. QSPR Modeling of the Reactivity Parameters of Monomers in Radical Copolymerizations

    Andrey A. Toropov, В. О. Кудышкин, Н. Л. Воропаева +2

    СтатьяComputational Drug Discovery MethodsJournal of Structural Chemistry2004Цитирований: 2
    ABI

  13. QSAR of the testosterone binding globulin affinity by means of correlation weighting of local invariants of the graph of atomic orbitals

    Ivan Raška, Andrey A. Toropov

    СтатьяMolecular spectroscopy and chiralityBioorganic & Medicinal Chemistry2005Цитирований: 2
    ABI

  14. QSPR modeling of the water solubility of diverse functional aliphatic compounds by optimization of correlation weights of local graph invariants

    Kunal Roy, Andrey A. Toropov

    СтатьяComputational Drug Discovery MethodsJournal of Molecular Modeling2005Цитирований: 1
    ABI

  15. QSPR modeling of octanol/water partition coefficient for vitamins by optimal descriptors calculated with SMILES

    Andrey A. Toropov, Alla P. Toropova, Ivan Raška

    СтатьяComputational Drug Discovery MethodsEuropean Journal of Medicinal Chemistry2007Цитирований: 1
    ABI

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

    Andrey A. Toropov, Emilio Benfenati

    СтатьяComputational Drug Discovery MethodsBioorganic & Medicinal Chemistry2008Цитирований: 1
    ABI

  17. SMILES‐based optimal descriptors: QSAR analysis of fullerene‐based HIV‐1 PR inhibitors by means of balance of correlations

    Andrey A. Toropov, Alla P. Toropova, Emilio Benfenati +2

    СтатьяComputational Drug Discovery MethodsJournal of Computational Chemistry2009Цитирований: 1
    ABI

  18. <i>Aconitum</i>and<i>Delphinium</i>Diterpenoid Alkaloids of Local Anesthetic Activity: Comparative QSAR Analysis Based on GA-MLRA/PLS and Optimal Descriptors Approach

    Malakhat A. Turabekova, Bakhtiyor Rasulev, F. N. Dzhakhangirov +3

    СтатьяPlant-based Medicinal ResearchJournal of Environmental Science and Health Part C2014Цитирований: 1
    ABI

  19. Optimal descriptors as a tool to predict the thermal decomposition of polymers

    Alla P. Toropova, Andrey A. Toropov, В. О. Кудышкин +2

    СтатьяThermal and Kinetic AnalysisJournal of Mathematical Chemistry2014Цитирований: 1
    ABI

  20. The system of self-consistent QSPR-models for refractive index of polymers

    Andrey A. Toropov, Alla P. Toropova, В. О. Кудышкин

    СтатьяComputational Drug Discovery MethodsStructural Chemistry2022Цитирований: 1
    ABI

  21. QSAR modelling of carcinogenicity by balance of correlations

    Andrey A. Toropov, Alla P. Toropova, Emilio Benfenati +1

    СтатьяAdvanced Chemical Sensor TechnologiesMolecular Diversity2009Цитирований: 1
    ABI

  22. QSPR modeling of octanol/water partition coefficient of antineoplastic agents by balance of correlations

    Andrey A. Toropov, Alla P. Toropova, Ivan Raška +1

    СтатьяComputational Drug Discovery MethodsEuropean Journal of Medicinal Chemistry2010Цитирований: 1
    ABI

  23. QSPR modeling of the half-wave potentials of benzoxazines by optimal descriptors calculated with the SMILES

    Andrey A. Toropov, Karel Nesměrák, Ivan Raška +2

    СтатьяPhenothiazines and Benzothiazines Synthesis and ActivitiesComputational Biology and Chemistry2006Цитирований: 1
    ABI

  24. 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

    СтатьяComputational Drug Discovery MethodsJournal of Molecular Structure THEOCHEM2004Цитирований: 1
    ABI

  25. Comparison of QSAR models of anti-HIV-1 potencies based on labeled hydrogen filled graph and graph of atomic orbitals

    Andrey A. Toropov, Alla P. Toropova, I.V. Nesterov +1

    СтатьяHIV/AIDS drug development and treatmentJournal of Molecular Structure THEOCHEM2003Цитирований: 1
    ABI