Concepedia
Journal of Computer-Aided Molecular Design · 2007 · 2.1K citations · 4 references
PharmacyMedicinal ChemistryPharmacologyComputational ChemistryDrug DesignDrug DiscoveryComputational Drug DiscoveryMolecular ModelingMolecular Property PredictionCheminformatics ModelingComputational Pka PredictionPka CalculationsProtonation EffectsProtonation State Prediction
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Accurate Prediction of Acidity Constants in Aqueous Solution via Density Functional Theory and Self-Consistent Reaction Field Methods
Jasna Klicić, Richard A. Friesner, Shiyi Liu et al. · The Journal of Physical Chemistry A · 2002 · 284 citations
Natural Sciences, Chemistry, Physics +17
Prediction of the strengths of organic acids
G. B. BARLIN, D. D. Perrin · Quarterly Reviews Chemical Society · 1966 · 241 citations
Natural Sciences, Chemistry, Organic Chemistry +6
Prediction of the strengths of organic bases
J. Stephen Clark, D. D. Perrin · Quarterly Reviews Chemical Society · 1964 · 215 citations
Natural Sciences, Chemistry, Organic Chemistry +7
1042. Prediction of the strengths of some organic bases
D. D. Perrin · Journal of the Chemical Society (Resumed) · 1965 · 23 citations