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@qtchem

QTChem

Queen's Theoretical Chemistry @ FHZLab

Popular repositories

  1. neural-fingerprint neural-fingerprint Public

    Forked from HIPS/neural-fingerprint

    Convolutional nets which can take molecular graphs of arbitrary size as input.

    TeX

  2. temp temp Public

    Temporary public repo for accessing Jupyter noteboons through Google Colab

    Jupyter Notebook 2

  3. Heidar-Zadeh-Group-Website Heidar-Zadeh-Group-Website Public

    Source Code for the Heidar-Zadeh Group Website

    HTML

  4. Promolecular Promolecular Public

    Python

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