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AkademIndex

Xizmatlar

Emilio Benfenati

28 ta ish

Mario Negri Institute for Pharmacological Research

AkademScholarda batafsil koʻrsatkichlar

  1. Optimisation of correlation weights of SMILES invariants for modelling oral quail toxicity

    Andrey A. Toropov, Emilio Benfenati

    Maqola20068 iqtibos
    ABI

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

    Andrey A. Toropov, Emilio Benfenati

    MaqolaComputational Drug Discovery MethodsCurrent Drug Discovery Technologies20075 iqtibos
    ABI

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

    Andrey A. Toropov, Emilio Benfenati

    MaqolaComputational Drug Discovery MethodsBioorganic & Medicinal Chemistry20084 iqtibos
    ABI

  4. SMILES as an alternative to the graph in QSAR modelling of bee toxicity

    Andrey A. Toropov, Emilio Benfenati

    Maqola20074 iqtibos
    ABI

  5. Green Chemistry in the Synthesis of Pharmaceuticals

    Supratik Kar, Hans Sanderson, Kunal Roy +2

    Sharh maqola20213 iqtibos
    ABI

  6. QSAR modelling of aldehyde toxicity against a protozoan, Tetrahymena pyriformis by optimization of correlation weights of nearest neighboring codes

    Andrey A. Toropov, Emilio Benfenati

    Maqola20043 iqtibos
    ABI

  7. QSAR modelling of aldehyde toxicity by means of optimisation of correlation weights of nearest neighbouring codes

    Andrey A. Toropov, Emilio Benfenati

    Maqola20043 iqtibos
    ABI

  8. QSAR modelling of carcinogenicity by balance of correlations

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

    MaqolaAdvanced Chemical Sensor TechnologiesMolecular Diversity20092 iqtibos
    ABI

  9. Additive SMILES-Based Carcinogenicity Models: Probabilistic Principles in the Search for Robust Predictions

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

    MaqolaOchiq kirish20092 iqtibos
    ABI

  10. QSPR modeling for enthalpies of formation of organometallic compounds by means of SMILES-based optimal descriptors

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

    Maqola20082 iqtibos
    ABI

  11. Coral: QSPR modeling of rate constants of reactions between organic aromatic pollutants and hydroxyl radical

    Andrey A. Toropov, Alla P. Toropova, Bakhtiyor Rasulev +4

    Maqola20122 iqtibos
    ABI

  12. QSAR Modelling for Mutagenic Potency of Heteroaromatic Amines by Optimal SMILES‐based Descriptors

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

    Maqola20092 iqtibos
    ABI

  13. CORAL: Quantitative structure–activity relationship models for estimating toxicity of organic compounds in rats

    Alla P. Toropova, Andrey A. Toropov, Emilio Benfenati +3

    Maqola20112 iqtibos
    ABI

  14. The self-organizing vector of atom-pairs proportions: use to develop models for melting points

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

    Maqola20212 iqtibos
    ABI

  15. Correlation weighting of valence shells in QSAR analysis of toxicity

    Andrey A. Toropov, Emilio Benfenati

    Maqola20062 iqtibos
    ABI

  16. QSAR models for ACE-inhibitor activity of tri-peptides based on representation of the molecular structure by graph of atomic orbitals and SMILES

    Alla P. Toropova, Andrey A. Toropov, Bakhtiyor Rasulev +4

    Maqola20122 iqtibos
    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

    MaqolaComputational Drug Discovery MethodsJournal of Computational Chemistry20091 iqtibos
    ABI

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

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

    MaqolaComputational Drug Discovery MethodsEuropean Journal of Medicinal Chemistry20101 iqtibos
    ABI

  19. Simplified Molecular Input Line Entry System‐Based Optimal Descriptors: Quantitative Structure–Activity Relationship Modeling Mutagenicity of Nitrated Polycyclic Aromatic Hydrocarbons

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

    Maqola20091 iqtibos
    ABI

  20. SMILES-based optimal descriptors: QSAR modeling of carcinogenicity by balance of correlations with ideal slopes

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

    Maqola20101 iqtibos
    ABI

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

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

    MaqolaComputational Drug Discovery MethodsMolecular Diversity20090 iqtibos
    ABI

  22. QSAR modelling of the toxicity to Tetrahymena pyriformis by balance of correlations

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

    MaqolaComputational Drug Discovery MethodsMolecular Diversity20090 iqtibos
    ABI

  23. QSPR modeling of enthalpies of formation for organometallic compounds by SMART‐based optimal descriptors

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

    MaqolaComputational Drug Discovery MethodsJournal of Computational Chemistry20090 iqtibos
    ABI

  24. QSPR modeling bioconcentration factor (BCF) by balance of correlations

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

    Maqola20090 iqtibos
    ABI

  25. QSPR modelling of the octanol/water partition coefficient of organometallic substances by optimal SMILES-based descriptors

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

    MaqolaOchiq kirish20090 iqtibos
    ABI