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@AstraZeneca

AstraZeneca

Data and AI: Unlocking new science insights

Pinned

  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 700 88

  4. rexmex rexmex Public

    A general purpose recommender metrics library for fair evaluation.

    Python 275 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 61 repositories
  • jazzy Public

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

    Python 71 6 0 12 Updated Apr 25, 2024
  • Python 0 0 0 0 Updated Apr 25, 2024
  • runnable Public

    Runnable

    Python 36 Apache-2.0 4 1 3 Updated Apr 24, 2024
  • KAZU Public

    Fast, world class biomedical NER

    Python 58 Apache-2.0 4 6 0 Updated Apr 17, 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 Apr 12, 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 0 Updated Apr 12, 2024
  • dpp_imp Public

    Improved clinical data imputation via classical and quantum determinantal point processes

    Python 1 0 0 1 Updated Apr 3, 2024
  • MCPL Public

    ICML 2024 submission - An image is worth multiple words: learning object level concepts using multi-concepts prompts learning.

    Python 2 Apache-2.0 0 0 0 Updated Apr 1, 2024
  • Jupyter Notebook 0 0 0 2 Updated Mar 21, 2024
  • maraca Public

    R package for the creation of "maraca" plots

    R 3 0 0 0 Updated Mar 18, 2024