Перейти к основному содержанию
AkademIndex

Продукты

Для разработчиков

AkademBaseОткрытый API экосистемы

Alla P. Toropova

Работ: 38

Laboratory of Environmental Chemistry and Toxicology, Istituto di Ricerche Farmacologiche Mario Negri IRCCS, Via Mario Negri 2, 20156, Milan, Italy

  1. 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

  2. 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

  3. 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

  4. 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

  5. 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

  6. 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

  7. 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

  8. 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

  9. 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

  10. 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

  11. 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

  12. QSAR modelling of carcinogenicity by balance of correlations

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

    СтатьяAdvanced Chemical Sensor TechnologiesMolecular Diversity2009Цитирований: 1
    ABI

  13. 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

  14. 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

  15. 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

  16. Building Up QSPR for Polymers Endpoints by Using SMILES-Based Optimal Descriptors

    В. О. Кудышкин, Alla P. Toropova

    ГлаваComputational Drug Discovery MethodsChallenges and advances in computational chemistry and physics2023Цитирований: 1
    ABI

  17. Generalized zero-order molecular connectivity index: enthalpies of crystalline aquo and ammino complexes in qspr modeling

    Andrey A. Toropov, Alla P. Toropova, Н. Л. Воропаева +2

    СтатьяChemical Thermodynamics and Molecular Structure1998Цитирований: 1
    ABI

  18. The use of deformation indices of the ideal symmetry model in calculations of the thermodynamic properties of organic compounds

    Andrey A. Toropov, Alla P. Toropova, Т. Т. Исмаилов +3

    СтатьяChemical Thermodynamics and Molecular StructureRussian Journal of Physical Chemistry A1996Цитирований: 0
    ABI

  19. Approval of the random-mutual-orientation statistics index as a basis for searching for "structure-property" relationships in coordination compounds

    Andrey A. Toropov, Alla P. Toropova, Н. Л. Воропаева +2

    СтатьяChemical Thermodynamics and Molecular Structure1996Цитирований: 0
    ABI

  20. Extended molecular connectivity: Prediction of boiling points of alkanes

    Andrey A. Toropov, Alla P. Toropova, Т. Т. Исмаилов +2

    СтатьяComputational Drug Discovery MethodsJournal of Structural Chemistry1997Цитирований: 0
    ABI

  21. Correlations of indices calculated from the matrix of maximal topological distances with boiling points of alkylbenzenes

    Andrey A. Toropov, Alla P. Toropova, Т. Т. Исмаилов +2

    СтатьяGraph theory and applicationsJournal of Structural Chemistry1997Цитирований: 0
    ABI

  22. Using the maximal topological distance matrix for QSPR modeling of the boiling points of cyclic hydrocarbons

    Andrey A. Toropov, Alla P. Toropova, Н. Л. Воропаева +2

    СтатьяComputational Drug Discovery MethodsJournal of Structural Chemistry1999Цитирований: 0
    ABI

  23. Testing the atomic orbital graph as a basis for QSPR modeling of the boiling points of haloalkanes

    Andrey A. Toropov, Alla P. Toropova, Н. Л. Воропаева +2

    СтатьяComputational Drug Discovery MethodsJournal of Structural Chemistry1999Цитирований: 0
    ABI

  24. Two concepts of weighing molecular graph local invariants in QSPR modeling of the enthalpies of complexes: Sampling of increments and optimization of correlation weights

    Andrey A. Toropov, Alla P. Toropova, Н. Л. Воропаева +2

    СтатьяComputational Drug Discovery Methods1999Цитирований: 0
    ABI

  25. QSPR modeling of Gibbs free energy of chemical transformations of oil shale components during thermal treatment

    Eduardo A. Castro, Alla P. Toropova, Andrey A. Toropov +1

    СтатьяHydrocarbon exploration and reservoir analysisSSRN Electronic Journal2003Цитирований: 0
    ABI