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@AstraZeneca

AstraZeneca

Data and AI: Unlocking new science insights

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  1. awesome-explainable-graph-reasoning awesome-explainable-graph-reasoning Public

    A collection of research papers and software related to explainability in graph machine learning.

    2k 135

  2. chemicalx chemicalx Public

    A PyTorch and TorchDrug based deep learning library for drug pair scoring. (KDD 2022)

    Python 766 99

  3. rexmex rexmex Public

    A general purpose recommender metrics library for fair evaluation.

    Python 277 25

  4. SubTab SubTab Public

    The official implementation of the paper, "SubTab: Subsetting Features of Tabular Data for Self-Supervised Representation Learning"

    Python 150 21

  5. onto_merger onto_merger Public

    OntoMerger is an ontology alignment library for deduplicating knowledge graph nodes that represent the same domain.

    HTML 102 6

  6. jazzy jazzy Public

    Fast calculation of hydrogen-bond strengths and free energy of hydration of small molecules.

    Python 93 9

Repositories

Showing 10 of 93 repositories
  • coving-index-demo Public

    Minimal, reproducible Python implementation of the Coving Index — a novel endpoint introduced in our publication.

    AstraZeneca/coving-index-demo’s past year of commit activity
    Jupyter Notebook 0 0 0 0 Updated Jan 23, 2026
  • cellatria Public

    An Agentic AI Framework for Ingestion and Standardization of Single-Cell RNA-seq Data Analysis

    AstraZeneca/cellatria’s past year of commit activity
    Python 31 Apache-2.0 7 0 0 Updated Jan 23, 2026
  • runnable Public

    Runnable

    AstraZeneca/runnable’s past year of commit activity
    Python 51 Apache-2.0 5 7 3 Updated Jan 22, 2026
  • regflow Public
    AstraZeneca/regflow’s past year of commit activity
    R 0 MIT 1 0 0 Updated Jan 15, 2026
  • maraca Public

    R package for the creation of "maraca" plots

    AstraZeneca/maraca’s past year of commit activity
    R 3 2 2 1 Updated Jan 14, 2026
  • biomedical-kg-topological-imbalance Public

    Code to accompany the "Implications of Topological Imbalance for Representation Learning on Biomedical Knowledge Graphs" (Briefings in Bioinformatics, 2022)

    AstraZeneca/biomedical-kg-topological-imbalance’s past year of commit activity
    Jupyter Notebook 19 Apache-2.0 0 0 3 Updated Jan 8, 2026
  • kgem-in-drug-discovery Public

    Code to accompany the "Understanding the Performance of Knowledge Graph Embeddings in Drug Discovery" manuscript (Artificial Intelligence in the Life Sciences, 2022)

    AstraZeneca/kgem-in-drug-discovery’s past year of commit activity
    Python 34 Apache-2.0 6 0 2 Updated Jan 8, 2026
  • peptide-tools Public

    Collection of tools to calculate properties of natural or synthetic peptides and proteins.

    AstraZeneca/peptide-tools’s past year of commit activity
    Python 54 MIT 9 0 0 Updated Dec 24, 2025
  • jazzy Public

    Fast calculation of hydrogen-bond strengths and free energy of hydration of small molecules.

    AstraZeneca/jazzy’s past year of commit activity
    Python 93 9 1 22 Updated Dec 5, 2025
  • mosses Public

    Toolkit for analysing molecular property predictive models.

    AstraZeneca/mosses’s past year of commit activity
    Python 0 Apache-2.0 0 0 0 Updated Nov 25, 2025
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