Modelling the correlation between molecular electrostatic potential and pKa on sets of carboxylic acids, phenols and anilines

URN:NBN:SI:doc-8UEP8QDE2017Drvarič Talian, SaraHribar, BarbaraPodlipnik, ČrtomirVirant, Mihadocuments/doc/8/URN_NBN_SI_doc-8UEP8QDE_001.pdfdocuments/doc/8/URN_NBN_SI_doc-8UEP8QDE_001.txt364articlestr. 560-5631318-02071537505219URN:NBN:SI:doc-8UEP8QDEengSlovensko kemijsko društvoActa chimica slovenicaBYkvantnomehanski izračunimolecular electrostatic potentialmolekulski elektrostatski potencialmultivariable linear regressionpKaquantum mechanical calculationsvečparametrska linearna regresijaModelling the correlation between molecular electrostatic potential and pKa on sets of carboxylic acids, phenols and anilines