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Creators/Authors contains: "Sowndarya_S_V, Shree"

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  1. ; ; ; ; ; ; (, Digital Discovery)
    DFT-level descriptor libraries were constructed to train 2D and 3D graph neural networks for on the-fly the prediction of carboxylic acid and alkyl amine descriptors suitable for statistical modeling of medicinally relevant molecules. 
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    Free, publicly-accessible full text available January 15, 2026
  2. ; ; ; ; ; ; ; ; ; (, Journal of the American Chemical Society)
    Free, publicly-accessible full text available November 20, 2025