Uniting Cheminformatics and Chemical Theory To Predict the Intrinsic Aqueous Solubility of Crystalline Druglike Molecules

James Mcdonagh, James L McDonagh, Neetika Nath, Luna De Ferrari, Tanja van Mourik, John B O Mitchell

    Research output: Contribution to journalArticlepeer-review

    Original languageEnglish
    Pages (from-to)844-856
    Number of pages13
    JournalJournal of Chemical Information and Modeling
    Volume54
    Issue number3
    Publication statusPublished - 2014

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