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  1. chembl_webresource_client chembl_webresource_client Public

    Official Python client for accessing ChEMBL API

    Python 382 92

  2. ChEMBL_Structure_Pipeline ChEMBL_Structure_Pipeline Public

    ChEMBL database structure pipelines

    Python 197 38

  3. FPSim2 FPSim2 Public

    Simple package for fast molecular similarity searches

    Python 115 19

  4. GLaDOS GLaDOS Public

    Web Interface for ChEMBL @ EMBL-EBI

    JavaScript 47 6

  5. tractability_pipeline_v2 tractability_pipeline_v2 Public

    Pipeline for assessing the tractability of potential targets (starting from Gene IDs)

    Python 20 8

  6. chembl_multitask_model chembl_multitask_model Public

    Target prediction multitask neural network, with examples running it in Python, C++, Julia and JS

    Python 14 9

Repositories

Showing 10 of 71 repositories
  • FPSim2 Public

    Simple package for fast molecular similarity searches

    chembl/FPSim2’s past year of commit activity
    Python 115 MIT 19 4 0 Updated Dec 25, 2024
  • chembl_multitask_model Public

    Target prediction multitask neural network, with examples running it in Python, C++, Julia and JS

    chembl/chembl_multitask_model’s past year of commit activity
    Python 14 9 0 0 Updated Dec 18, 2024
  • GLaDOS-docs Public

    Repository for storing the source files of the new interface documentation. https://chembl.gitbook.io/chembl-interface-documentation/

    chembl/GLaDOS-docs’s past year of commit activity
    8 3 0 0 Updated Dec 11, 2024
  • libRDChEBI Public
    chembl/libRDChEBI’s past year of commit activity
    Python 0 MIT 1 3 0 Updated Sep 11, 2024
  • ChEMBL_Structure_Pipeline Public

    ChEMBL database structure pipelines

    chembl/ChEMBL_Structure_Pipeline’s past year of commit activity
    Python 197 MIT 38 5 2 Updated Sep 3, 2024
  • cbl_migrator Public

    Migrates Oracle DBs to PostgreSQL, MySQL and SQLite

    chembl/cbl_migrator’s past year of commit activity
    Python 7 MIT 2 0 1 Updated Sep 3, 2024
  • unichem2index Public

    Queries Unichem's DB and Indexes the structure data into an Elasticsearch Index

    chembl/unichem2index’s past year of commit activity
    Go 1 MIT 1 0 0 Updated Jul 25, 2024
  • tractability_pipeline_v2 Public

    Pipeline for assessing the tractability of potential targets (starting from Gene IDs)

    chembl/tractability_pipeline_v2’s past year of commit activity
    Python 20 MIT 8 0 2 Updated Jul 22, 2024
  • surechembl-data-client Public

    A collection of scripts for retrieving, storing, and querying SureChEMBL data.

    chembl/surechembl-data-client’s past year of commit activity
    Python 36 MIT 17 6 5 Updated Jul 11, 2024
  • ChEMBL_NTD-Markdown Public

    Markdown files for the new ChEMBL_NTD page: https://chembl.gitbook.io/chembl-ntd/

    chembl/ChEMBL_NTD-Markdown’s past year of commit activity
    4 4 0 0 Updated Jun 13, 2024