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  1. 27Al_CQ_prediction 27Al_CQ_prediction Public

    Random forest/XGBoost models for fast prediction of Solid-State NMR EFG CQ parameter for 27Al compounds.

    Jupyter Notebook 1

  2. Image_binary_classification_from_scratch Image_binary_classification_from_scratch Public

    Build a N layer feed-forward ANN from scratch and perform image classification

    Jupyter Notebook

  3. monte_carlo_sampling_NMR_params monte_carlo_sampling_NMR_params Public

    Sampling the posterior distribution of NMR parameters fitted by Mrsimulator with Monte Carlo.

    Jupyter Notebook 1

  4. mrsimulator mrsimulator Public

    Forked from deepanshs/mrsimulator

    A fast solid-state NMR spectrum simulation and analysis library.

    Python 1