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Andrey A. Toropov
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Journal Articles
- 2021
- [j20]Alla P. Toropova, Andrey A. Toropov, Alessandra Roncaglioni, Emilio Benfenati:
The index of ideality of correlation improves the predictive potential of models of the antioxidant activity of tripeptides from frog skin (Litoria rubella). Comput. Biol. Medicine 133: 104370 (2021) - [j19]Alla P. Toropova, Andrey A. Toropov, Danuta Leszczynska, Jerzy Leszczynski:
Application of quasi-SMILES to the model of gold-nanoparticles uptake in A549 cells. Comput. Biol. Medicine 136: 104720 (2021) - 2019
- [j18]Andrey A. Toropov, Alla P. Toropova, Danuta Leszczynska, Jerzy Leszczynski:
"Ideal correlations" for biological activity of peptides. Biosyst. 181: 51-57 (2019) - 2018
- [j17]Alla P. Toropova, Andrey A. Toropov, Emilio Benfenati, Danuta Leszczynska, Jerzy Leszczynski:
Prediction of antimicrobial activity of large pool of peptides using quasi-SMILES. Biosyst. 169-170: 5-12 (2018) - [j16]Alla P. Toropova, Andrey A. Toropov:
CORAL: QSAR models for carcinogenicity of organic compounds for male and female rats. Comput. Biol. Chem. 72: 26-32 (2018) - 2015
- [j15]Mariya A. Toropova, Aleksandar M. Veselinovic, Jovana B. Veselinovic, Dusica B. Stojanovic, Andrey A. Toropov:
QSAR modeling of the antimicrobial activity of peptides as a mathematical function of a sequence of amino acids. Comput. Biol. Chem. 59: 126-130 (2015) - [j14]Mariya A. Toropova, Andrey A. Toropov, Ivan Raska Jr., Mária Rasková:
Searching therapeutic agents for treatment of Alzheimer disease using the Monte Carlo method. Comput. Biol. Medicine 64: 148-154 (2015) - 2014
- [j13]Andrey A. Toropov, Alla P. Toropova, Ivan Raska Jr., Danuta Leszczynska, Jerzy Leszczynski:
Comprehension of drug toxicity: Software and databases. Comput. Biol. Medicine 45: 20-25 (2014) - 2012
- [j12]Alla P. Toropova, Andrey A. Toropov, Anna Lombardo, Alessandra Roncaglioni, Emilio Benfenati, Giuseppina C. Gini:
Coral: QSAR models for acute toxicity in fathead minnow (Pimephales promelas). J. Comput. Chem. 33(12): 1218-1223 (2012) - [j11]Andrey A. Toropov, Alla P. Toropova, Bakhtiyor F. Rasulev, Emilio Benfenati, Giuseppina C. Gini, Danuta Leszczynska, Jerzy Leszczynski:
Coral: QSPR modeling of rate constants of reactions between organic aromatic pollutants and hydroxyl radical. J. Comput. Chem. 33(23): 1902-1906 (2012) - 2011
- [j10]Alla P. Toropova, Andrey A. Toropov, Emilio Benfenati, Giuseppina C. Gini, Danuta Leszczynska, Jerzy Leszczynski:
CORAL: Quantitative structure-activity relationship models for estimating toxicity of organic compounds in rats. J. Comput. Chem. 32(12): 2727-2733 (2011) - 2010
- [j9]Andrey A. Toropov, Alla P. Toropova, Emilio Benfenati, Danuta Leszczynska, Jerzy Leszczynski:
SMILES-based optimal descriptors: QSAR analysis of fullerene-based HIV-1 PR inhibitors by means of balance of correlations. J. Comput. Chem. 31(2): 381-392 (2010) - 2009
- [j8]Andrey A. Toropov, Alla P. Toropova, Emilio Benfenati, Alberto Manganaro:
QSPR modeling of enthalpies of formation for organometallic compounds by SMART-based optimal descriptors. J. Comput. Chem. 30(15): 2576-2582 (2009) - 2007
- [j7]Andrey A. Toropov, Emilio Benfenati:
SMILES as an alternative to the graph in QSAR modelling of bee toxicity. Comput. Biol. Chem. 31(1): 57-60 (2007) - [j6]Andrey A. Toropov, Danuta Leszczynska, Jerzy Leszczynski:
Predicting water solubility and octanol water partition coefficient for carbon nanotubes based on the chiral vector. Comput. Biol. Chem. 31(2): 127-128 (2007) - 2006
- [j5]Andrey A. Toropov, Karel Nesmerak Jr., Ivan Raska Jr., Karel Waisser, Karel Palat:
QSPR modeling of the half-wave potentials of benzoxazines by optimal descriptors calculated with the SMILES. Comput. Biol. Chem. 30(6): 434-437 (2006) - 2004
- [j4]Andrey A. Toropov, Kunal Roy:
QSPR Modeling of Lipid-Water Partition Coefficient by Optimization of Correlation Weights of Local Graph Invariants. J. Chem. Inf. Model. 44(1): 179-186 (2004) - 2003
- [j3]Andrey A. Toropov, T. Wayne Schultz:
Prediction of Aquatic Toxicity: Use of Optimization of Correlation Weights of Local Graph Invariants. J. Chem. Inf. Comput. Sci. 43(2): 560-567 (2003) - 2002
- [j2]Pablo Duchowicz, Eduardo A. Castro, Andrey A. Toropov:
Improved QSPR Analysis of Standard Entropy of Acyclic and Aromatic Compounds using Optimized Correlation Weights of Linear Graph Invariants. Comput. Chem. 26(4): 327-332 (2002) - 2000
- [j1]Eduardo A. Castro, Matías Tueros, Andrey A. Toropov:
Maximum Topological Distances Based Indices As Molecular Descriptors for QSPR: 2 - Application to Aromatic Hydrocarbons. Comput. Chem. 24(5): 571-576 (2000)
Conference and Workshop Papers
- 2007
- [c1]Andrey A. Toropov:
An Effective Visualization and Analysis Method for Edge Measurement. ICCSA (2) 2007: 941-950
Coauthor Index
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