Data Underpinning: Toward physics-based solubility computation for pharmaceuticals to rival informatics

Dataset

Description

Detailed description and tabulation of data relating to: Toward physics-based solubility computation for pharmaceuticals to rival informatics This dataset also includes R scripts used for machine learning predictions of the solubilities of the three compounds considered in this study.

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Date made available27 Apr 2023
PublisherUniversity of St Andrews
Date of data production2014

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