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Leszczynski, Jerzy
One or more keywords matched the following items that are connected to
Leszczynski, Jerzy
Item Type
Name
Academic Article
Homonuclear versus heteronuclear resonance-assisted hydrogen bonds: tautomerism, aromaticity, and intramolecular hydrogen bonding in heterocyclic systems with different exocyclic proton donor/acceptor.
Academic Article
CORAL: QSPR modeling of rate constants of reactions between organic aromatic pollutants and hydroxyl radical.
Academic Article
Predictions of Gibbs free energies for the adsorption of polyaromatic and nitroaromatic environmental contaminants on carbonaceous materials: efficient computational approach.
Academic Article
A quantum chemical based toxicity study of estimated reduction potential and hydrophobicity in series of nitroaromatic compounds.
Academic Article
Endocrine-disrupting activity of per- and polyfluoroalkyl substances: Exploring combined approaches of ligand and structure based modeling.
Academic Article
QSAR modeling of adipose/blood partition coefficients of Alcohols, PCBs, PBDEs, PCDDs and PAHs: A data gap filling approach.
Academic Article
Single or mixture halogenated chemicals? Risk assessment and developmental toxicity prediction on zebrafish embryos based on weighted descriptors approach.
Academic Article
Molecular structure and vibrational raman and infrared spectra of bromochlorofluoromethane and its silicon and germanium analogs: quantum-mechanical DFT and MP2 calculations.
Academic Article
UVA light-induced DNA cleavage by isomeric methylbenz[a]anthracenes.
Academic Article
Structure-toxicity relationships of nitroaromatic compounds.
Academic Article
The effect of nitroaromatics' composition on their toxicity in vivo: novel, efficient non-additive 1D QSAR analysis.
Academic Article
Prediction of rate constants for radical degradation of aromatic pollutants in water matrix: a QSAR study.
Academic Article
Light-induced cytotoxicity of 16 polycyclic aromatic hydrocarbons on the US EPA priority pollutant list in human skin HaCaT keratinocytes: relationship between phototoxicity and excited state properties.
Concept
Hydrocarbons, Aromatic
Concept
Hydrocarbons, Fluorinated
Concept
Hydrocarbons, Halogenated
Search Criteria
Hydrocarbons