Aquatic Toxicities of Halogenated Benzoic Acids to Tetrahymena pyriformis [1] |
Aquatic toxicity and abiotic thiol reactivity of aliphatic isothiocyanates: Effects of alkyl-size and -shape [1] |
Aquatic toxicology of nitrogen heterocyclic molecules: Quantitative structure-activity relationships [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] |
Binary and multi-class classification for androgen receptor agonists, antagonists and binders [1] |
Characterization and prediction of double-layer capacitance of nanoporous carbon materials using the Quantitative nano-Structure-Property Relationship approach based on experimentally determined porosity descriptors. [1] |
Chemical Structure and Correlation Analysis of HIV-1 NNRT and NRT Inhibitors and Database-Curated, Published Inhibition Constants with Chemical Structure in Diverse Datasets [1] |
Chemistry-Toxicity Relationships for the Effects of Di- and Trihydroxybenzenes to Tetrahymena pyriformis [1] |
Classifying bio-concentration factor with random forest algorithm, influence of the bio-accumulative vs. non-bio-accumulative compound ratio to modelling result, and applicability domain for random forest model [1] |
Combined Naïve Bayesian, chemical fingerprints, and molecular docking classifiers to model and predict androgen receptor binding activity data for environmentally- and health-sensitive substances [1] |
Comparative assessment of methods to develop QSARs for the prediction of the toxicity of phenols to Tetrahymena pyriformis [1] |
Comparative toxicity of new halophenolic DBPs in chlorinated saline wastewater effluents against a marine alga: Halophenolic DBPs are generally more toxic than haloaliphatic ones [1] |
Comparative toxicity of selected nitrogen-containing aromatic compounds in the Tetrahymena pyriformis and Pimephales promelas test systems [1] |
Comparison of performance of docking, LIE, metadynamics and QSAR in predicting binding affinity of benzenesulfonamides [1] |
Comparison of Tetrahymena and Pimephales Toxicity Based on Mechanism of Action [1] |
Correlation of Tetrahymena and Pimephales Toxicity: Evaluation of 100 Additional Compounds [1] |
Correlations for the acute toxicity of multiple nitrogen substituted aromatic molecules [1] |
Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis [1] |
Development and validation of a quantitative structure-activity relationship for chronic narcosis to fish [1] |