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Random forest classifier of bond type

Getting started

  1. Clone and enter the code repository:

    git clone https://github.com/ninarina12/bond_classifier.git

    cd bond_classifier

  2. Create and activate the virtual environment for the project:

    conda env create -f environment.yml

    conda activate elf

  3. Run jupyter notebook and open process.ipynb to process data by identifying mixed bonds.

  4. Open predict.ipynb to make predictions using the trained models.

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