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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.

    1.9k 130

  2. kallisto kallisto Public

    Efficiently calculate 3D-features for quantitative structure-activity relationship approaches.

    Python 56 20

  3. chemicalx chemicalx Public

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

    Python 699 88

  4. rexmex rexmex Public

    A general purpose recommender metrics library for fair evaluation.

    Python 276 25

  5. SubTab SubTab Public

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

    Python 139 18

  6. onto_merger onto_merger Public

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

    HTML 90 5

Repositories

Showing 10 of 65 repositories
  • runnable Public

    Runnable

    Python 38 Apache-2.0 4 1 3 Updated May 9, 2024
  • multimodal-python-course Public

    The purpose of the code is to facilitate a comprehensive understanding of multimodal data science applications within medical domain. The code serves to support the delivery of a cutting-edge workshop designed to introduce researchers to the rapidly evolving field of multimodal data science

    Jupyter Notebook 0 Apache-2.0 0 0 0 Updated May 9, 2024
  • jazzy Public

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

    Python 71 6 0 14 Updated May 8, 2024
  • safeenv Public

    Safe R environment that raises an error if a key has never been defined, instead of returning NULL

    R 0 0 0 0 Updated May 7, 2024
  • biomedical-kg-topological-imbalance Public

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

    Jupyter Notebook 14 Apache-2.0 0 0 0 Updated May 7, 2024
  • qsuse Public

    R library that provides an import mechanism like python to import local source files. It is not meant to replace library(), or doublecolon:: prefixing

    R 0 0 0 0 Updated May 7, 2024
  • reactive6 Public

    Reactive R6 models for Shiny

    R 0 0 0 0 Updated May 7, 2024
  • peptide-tools Public

    Programs to calculate phys-chem properties of synthetic peptides and proteins: isoelectric point and extinction coefficients.

    Python 15 Apache-2.0 4 1 0 Updated May 7, 2024
  • 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)

    Python 29 Apache-2.0 6 0 1 Updated May 3, 2024
  • KAZU Public

    Fast, world class biomedical NER

    Python 59 Apache-2.0 4 6 1 Updated May 2, 2024
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