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  1. fup-transfer-learning fup-transfer-learning Public

    Jupyter notebook, R scripts, and tabular data files to support the publication "Deep Transfer Learning of a Quantitative Structure-Activity Relationship to Predict Fraction Unbound in Human Plasma …

    Jupyter Notebook

  2. ttr-binding-analysis ttr-binding-analysis Public

    Jupyter notebook and tabular data files to support the publication "Combined In vitro and In silico Workflow to Deliver Robust, Transparent, and Contextually Rigorous Models of Bioactivity" (Chares…

    Jupyter Notebook 1

  3. wikipedia-infoboxes wikipedia-infoboxes Public

    Query and processing code to support the publication "Wikipedia curation and the US-EPA CompTox Chemicals Dashboard" (Sinclair et al. 2022)

    Java 4 1

  4. NMCharest/tcpl2 NMCharest/tcpl2 Public

    Python translation of dose-response data analysis library

    Python

  5. pfasstruct pfasstruct Public

    Command-line utility to generate iterations of the PFASSTRUCT lists based on a fraction-fluorine and/or substructure-based definition as in the publication "A proposed approach to defining per- and…

    Python 1

  6. dtxsmarts dtxsmarts Public

    No-frills command-line SMARTS substructure search for DSSTOX

    Python