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  1. SMILES enumeration for QSAR modelling using LSTM recurrent neural networks

    Python 28 12

  2. Simple RDKit molecule editor GUI using PySide

    Python 9 4

  3. Using deep learning approaches and convolutional neural networks (CNN) for spectroscopical data (deep chemometrics)

    Jupyter Notebook 9 2

48 contributions in the last year

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Contribution activity

March 2019

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