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Popular repositories Loading

  1. rdkit-scripts rdkit-scripts Public

    A collection of cheminformatics scripts that use rdkit

    Python 63 33

  2. qsar-tools qsar-tools Public

    Scripts for assisting in modeling quantitative structure activity relationships from 2D chemical data

    Python 62 30

  3. md-scripts md-scripts Public

    A collections of scripts for working molecular dynamics simulations

    Python 43 20

  4. pharmit pharmit Public

    Open-source online virtual screening tools for large databases

    HTML 19 2

  5. show_contacts show_contacts Public

    PyMOL Plugin for displaying polar contacts

    Python 17 10

  6. shapedb shapedb Public

    C++ 16 4

304 contributions in the last year

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Activity overview

Contributed to 3dmol/3Dmol.js, gnina/gnina, gnina/libmolgrid and 11 other repositories
Loading A graph representing dkoes's contributions from April 07, 2024 to April 10, 2025. The contributions are 95% commits, 4% code review, 1% issues, 0% pull requests.

Contribution activity

April 2025

Created 4 commits in 1 repository
9 contributions in private repositories Apr 3 – Apr 8
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