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  1. AIOMFAC AIOMFAC Public

    Aerosol Inorganic-Organic Mixtures Functional groups Activity Coefficients (AIOMFAC) model code (used within the online model AIOMFAC-web)

    Fortran 22 6

  2. Fit_Data_by_Custom_Function Fit_Data_by_Custom_Function Public

    example code for how to run a best-of-random differential evolution optimization method in Fortran

    Fortran 1

  3. S2AS__SMILES_to_AIOMFAC S2AS__SMILES_to_AIOMFAC Public

    Automatic generation of AIOMFAC model input files based on molecular component SMILES

    Python

  4. Dislin_x_y_plot Dislin_x_y_plot Public

    A simplified and adjustable module to create 2D Dislin plots from Fortran

    Fortran 4

  5. 2D_Polarity_Volatility_lumping 2D_Polarity_Volatility_lumping Public

    2D framework for lumping of gas or aerosol components based on predicted polarity and volatility of molecules

    Fortran

  6. Machine-Learning-Surface-Tension Machine-Learning-Surface-Tension Public

    Forked from Rschmedding/Machine-Learning-Surface-Tension

    Machine Learning for Pure Component Surface Tensions

    Jupyter Notebook