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RDKit

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  1. rdkit rdkit Public

    The official sources for the RDKit library

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  • rdkit Public

    The official sources for the RDKit library

    rdkit/rdkit’s past year of commit activity
    HTML 2,518 BSD-3-Clause 853 915 59 Updated Jul 4, 2024
  • knime-rdkit Public

    The RDKit nodes for the KNIME Analytics Platform

    rdkit/knime-rdkit’s past year of commit activity
    Java 24 14 25 1 Updated Jul 4, 2024
  • rdkit-build-helpers Public

    Recipes to build RDKit artifacts (e.g., Java and C# libraries, NuGet packages) and some usage examples

    rdkit/rdkit-build-helpers’s past year of commit activity
    C# 1 BSD-3-Clause 3 0 0 Updated Jul 1, 2024
  • rdkit-js Public

    A powerful cheminformatics and molecule rendering toolbelt for JavaScript, powered by RDKit .

    rdkit/rdkit-js’s past year of commit activity
    Dockerfile 129 BSD-3-Clause 35 25 23 Updated Jul 1, 2024
  • rdkit-structure-renderer Public

    JavaScript package for interactive rendering of 2D chemical structures in the browser.

    rdkit/rdkit-structure-renderer’s past year of commit activity
    HTML 18 2 2 0 Updated Jun 17, 2024
  • UGM_2024 Public

    13th RDKit UGM. 11-13 September in Zurich, Switzerland

    rdkit/UGM_2024’s past year of commit activity
    9 0 0 0 Updated Jun 14, 2024
  • mmpdb Public

    A package to identify matched molecular pairs and use them to predict property changes.

    rdkit/mmpdb’s past year of commit activity
    Python 197 55 21 1 Updated Apr 30, 2024
  • django-rdkit Public
    rdkit/django-rdkit’s past year of commit activity
    Python 54 BSD-3-Clause 26 7 1 Updated Apr 29, 2024
  • mongo-rdkit Public

    GSoC 2020 project to integrate the RDKit and MongoDb

    rdkit/mongo-rdkit’s past year of commit activity
    Python 16 BSD-2-Clause 7 0 1 Updated Apr 8, 2024
  • shape-it Public

    Updated version of Silicos-it's shape-based alignment tool

    rdkit/shape-it’s past year of commit activity
    C++ 37 MIT 11 4 0 Updated Mar 23, 2024
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Most used topics

cheminformatics rdkit