Reliable prediction of sensory irritation threshold values of organic compounds using new models based on linear free energy relationships and GC× GC retention …
The human sensory irritation threshold (SIT) is an important biochemical parameter for the
exposure assessment of organic air pollutants. First, we recalibrated the Abraham solvation …
exposure assessment of organic air pollutants. First, we recalibrated the Abraham solvation …
Development and evaluation of two-parameter linear free energy models for the prediction of human skin permeability coefficient of neutral organic chemicals
S Naseem, Y Zushi, D Nabi - Journal of Cheminformatics, 2021 - Springer
The experimental values of skin permeability coefficients, required for dermal exposure
assessment, are not readily available for many chemicals. The existing estimation …
assessment, are not readily available for many chemicals. The existing estimation …
Predicting partitioning and diffusion properties of nonpolar chemicals in biotic media and passive sampler phases by GC× GC
The chemical parameters needed to explain and predict bioavailability, biodynamics, and
baseline toxicity are not readily available for most nonpolar chemicals detected in the …
baseline toxicity are not readily available for most nonpolar chemicals detected in the …
Air-Blood Partitioning of VOCs: Development of Two New Two-Parameter Parsimonious Models
The air-blood partition coefficient (K_ab) is an important determinant parameter for the
quantitative evaluation of absorption, diffusion, digestion, and excretion of volatile organic …
quantitative evaluation of absorption, diffusion, digestion, and excretion of volatile organic …