Accurate prediction of polarised high order electrostatic interactions for hydrogen bonded complexes using the machine learning method kriging

Timothy J Hughes, Shaun M Kandathil, Paul L A Popelier

    Research output: Contribution to journalArticlepeer-review

    Original languageEnglish
    Pages (from-to)32-41
    Number of pages10
    JournalSpectrochimica acta. Part A, Molecular and biomolecular spectroscopy
    Volume136 Pt A
    Publication statusPublished - 2015

    Cite this