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Popular repositories

  1. chemprop_transfer chemprop_transfer Public

    This package provides tools for transfer learning with chemprop

    Python 6 4

  2. pDOS_overlap pDOS_overlap Public

    Projected Density of States Overlap Calculations (pDOS_overlap)

    Python 4 1

  3. vp_model vp_model Public

    The Vapor Pressure Toolkit (VPT)

    Python 3

  4. jl_exp_deconv jl_exp_deconv Public

    Trains a model on experimental pure-component spectra to be used on experimental mixture spectra.

    Python

  5. jl_chrome_extensions jl_chrome_extensions Public

    JavaScript

  6. jl_spectra_2_structure jl_spectra_2_structure Public

    Methods for converting spectra to structure and solving the materials gap

    Python