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QsarDB Repository

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    Title
    ADMET Predictor - Bacterial mutagenicity model (MUT_m1535) [1]
    ADMET Predictor - Bacterial mutagenicity model (MUT_m97+1537) [1]
    ADMET Predictor - Bacterial mutagenicity model (MUT_m98) [1]
    ADMET Predictor - Bacterial mutagenicity model (MUT_NIHS) [1]
    ADMET Predictor - Bacterial mutagenicity model (MUT_Risk) [1]
    Adsorption behaviour and qspr studies of organotin compounds on estuarine sediment [1]
    An evaluation of global QSAR models for the prediction of the toxicity of phenols to Tetrahymena pyriformis [1]
    An exploratory study of the use of multivariate techniques to determine mechanisms of toxic action [1]
    An Update of the BCF QSAR Model Based on Theoretical Molecular Descriptors [1]
    Approaches for externally validated QSAR modelling of Nitrated Polycyclic Aromatic Hydrocarbon mutagenicity [1]
    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]