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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
Application of quantum chemical approximations to environmental problems: prediction of water solubility for nitro compounds.
Academic Article
New QSPR equations for prediction of aqueous solubility for military compounds.
Academic Article
Evaluation of the dependence of aqueous solubility of nitro compounds on temperature and salinity: a COSMO-RS simulation.
Academic Article
Toward robust computational electrochemical predicting the environmental fate of organic pollutants.
Academic Article
QSAR analysis of the toxicity of nitroaromatics in Tetrahymena pyriformis: structural factors and possible modes of action.
Academic Article
Predictions of Gibbs free energies for the adsorption of polyaromatic and nitroaromatic environmental contaminants on carbonaceous materials: efficient computational approach.
Academic Article
DFT M06-2X investigation of alkaline hydrolysis of nitroaromatic compounds.
Academic Article
Theoretical study of ionization and one-electron oxidation potentials of N-heterocyclic compounds.
Academic Article
A quantum chemical based toxicity study of estimated reduction potential and hydrophobicity in series of nitroaromatic compounds.
Academic Article
The effect of nitroaromatics' composition on their toxicity in vivo: novel, efficient non-additive 1D QSAR analysis.
Concept
Nitro Compounds
Academic Article
Decomposition of 2,4,6-trinitrotoluene (TNT) and 5-nitro-2,4-dihydro-3H-1,2,4-triazol-3-one (NTO) by Fe13O13 nanoparticle: density functional theory study.
Academic Article
NTO Degradation by Nitroreductase: A DFT Study.
Search Criteria
Nitro Compounds