A conceptual framework for predicting the toxicity of reactive chemicals: modeling soft electrophilicity [1] |
An evaluation of global QSAR models for the prediction of the toxicity of phenols to Tetrahymena pyriformis [1] |
Assessing Applicability Domains of Toxicological QSARs: Definition, Confidence in Predicted Values, and the Role of Mechanisms of Action [1] |
Assessment and Modeling of the Toxicity of Organic Chemicals to Chlorella vulgaris : Development of a Novel Database [1] |
Chemistry-Toxicity Relationships for the Effects of Di- and Trihydroxybenzenes to Tetrahymena pyriformis [1] |
Comparative assessment of methods to develop QSARs for the prediction of the toxicity of phenols to Tetrahymena pyriformis [1] |
Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis [1] |
Development of Quantitative Structure-Activity Relationships for the Toxicity of Aromatic Compounds to Tetrahymena pyriformis: Comparative Assessment of the Methodologies [1] |
Experimental Reactivity Parameters for Toxicity Modeling: Application to the Acute Aquatic Toxicity of SN2 Electrophiles to Tetrahymena pyriformis [1] |
Guidance for good practice in the application of machine learning in development of toxicological quantitative structure-activity relationships (QSARs) [1] |
Henry’s law constant of hydrocarbons in air–water system: The cavity ovality effect on the non-electrostatic contribution term of solvation free energy [1] |
Identification of Mechanisms of Toxic Action of Phenols to Tetrahymena pyriformis from Molecular Descriptors [1] |
Mechanistic Applicability Domains for Non-Animal Based Prediction of Toxicological Endpoints. QSAR Analysis of the Schiff Base Applicability Domain for Skin Sensitization [1] |
Multivariate Discrimination between Modes of Toxic Action of Phenols [1] |
Non polar narcosis QSAR for fathead minnow acute toxicity [1] |
Parametrization of Electrophilicity for the Prediction of the Toxicity of Aromatic Compounds [1] |
Partial Least Squares Modelling of the Acute Toxicity of Aliphatic Compounds to Tetrahymena pyriformis [1] |
Polar narcosis QSAR for fathead minnow acute toxicity [1] |
Predicting Skin Sensitization Potency for Michael Acceptors in the LLNA Using Quantum Mechanics Calculations [1] |
QSAR Study of the Toxicity of Nitrobenzenes to Tetrahymena pyriformis [1] |