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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 21

  3. chemicalx chemicalx Public

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

    Python 699 89

  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 138 20

  6. onto_merger onto_merger Public

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

    HTML 89 5

Repositories

30 results for all repositories written in Python sorted by last updated
Showing 10 of 30 repositories
  • jazzy Public

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

    Python 71 6 0 8 Updated May 30, 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 0 0 Updated May 29, 2024
  • MCPL Public

    Official implementation for "An image is worth multiple words: discovering object level concepts using multi-concepts prompts learning" [ICML 2024]]

    Python 2 Apache-2.0 0 0 0 Updated May 27, 2024
  • runnable Public

    Runnable

    Python 38 Apache-2.0 4 4 3 Updated May 23, 2024
  • Python 0 0 0 0 Updated May 22, 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 May 21, 2024
  • KAZU Public

    Fast, world class biomedical NER

    Python 61 Apache-2.0 4 6 1 Updated May 2, 2024
  • dpp_imp Public

    Improved clinical data imputation via classical and quantum determinantal point processes

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

    A package and environment manager for R

    Python 11 Apache-2.0 1 17 5 Updated Mar 8, 2024
  • SelfPAD Public

    The official implementation of "Improving Antibody Humanness Prediction using Patent Data".

    Python 3 Apache-2.0 1 0 0 Updated Feb 14, 2024