These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
163 related articles for article (PubMed ID: 24823316)
1. Predicting the pKa and stability of organic acids and bases at an oil-water interface. Andersson MP; Olsson MH; Stipp SL Langmuir; 2014 Jun; 30(22):6437-45. PubMed ID: 24823316 [TBL] [Abstract][Full Text] [Related]
2. Surfactant solutions and porous substrates: spreading and imbibition. Starov VM Adv Colloid Interface Sci; 2004 Nov; 111(1-2):3-27. PubMed ID: 15571660 [TBL] [Abstract][Full Text] [Related]
3. Contrasting pKa of protonated bis(3-aminopropyl)-terminated polyethylene glycol "Jeffamine" and the associated thermodynamic parameters in solution and covalently attached to graphite surfaces. Abiman P; Wildgoose GG; Crossley A; Jones JH; Compton RG Chemistry; 2007; 13(34):9663-7. PubMed ID: 17847153 [TBL] [Abstract][Full Text] [Related]
4. pH effects on molecular adsorption and solvation of p-nitrophenol at silica/aqueous interfaces. Woods BL; Walker RA J Phys Chem A; 2013 Jul; 117(29):6224-33. PubMed ID: 23701438 [TBL] [Abstract][Full Text] [Related]
5. Acidity constants from vertical energy gaps: density functional theory based molecular dynamics implementation. Sulpizi M; Sprik M Phys Chem Chem Phys; 2008 Sep; 10(34):5238-49. PubMed ID: 18728866 [TBL] [Abstract][Full Text] [Related]
6. Acidity of the Aqueous Rutile TiO2(110) Surface from Density Functional Theory Based Molecular Dynamics. Cheng J; Sprik M J Chem Theory Comput; 2010 Mar; 6(3):880-9. PubMed ID: 26613315 [TBL] [Abstract][Full Text] [Related]
7. Correlations and predictions of carboxylic acid pKa values using intermolecular structure and properties of hydrogen-bonded complexes. Tao L; Han J; Tao FM J Phys Chem A; 2008 Jan; 112(4):775-82. PubMed ID: 18179190 [TBL] [Abstract][Full Text] [Related]
8. The Silica-Water Interface: How the Silanols Determine the Surface Acidity and Modulate the Water Properties. Sulpizi M; Gaigeot MP; Sprik M J Chem Theory Comput; 2012 Mar; 8(3):1037-47. PubMed ID: 26593364 [TBL] [Abstract][Full Text] [Related]
9. Theoretical prediction of pKa values for methacrylic acid oligomers using combined quantum mechanical and continuum solvation methods. Dong H; Du H; Qian X J Phys Chem A; 2008 Dec; 112(49):12687-94. PubMed ID: 19053563 [TBL] [Abstract][Full Text] [Related]
10. pKa calculations in solution and proteins with QM/MM free energy perturbation simulations: a quantitative test of QM/MM protocols. Riccardi D; Schaefer P; Cui Q J Phys Chem B; 2005 Sep; 109(37):17715-33. PubMed ID: 16853267 [TBL] [Abstract][Full Text] [Related]
11. Accurate pKa determination for a heterogeneous group of organic molecules. Schmidt am Busch M; Knapp EW Chemphyschem; 2004 Oct; 5(10):1513-22. PubMed ID: 15535550 [TBL] [Abstract][Full Text] [Related]
12. Measurement of the p Wallace M; Abiama N; Chipembere M Anal Chem; 2023 Oct; 95(42):15628-15635. PubMed ID: 37830153 [TBL] [Abstract][Full Text] [Related]
13. Ionization state of L-phenylalanine at the air-water interface. Griffith EC; Vaida V J Am Chem Soc; 2013 Jan; 135(2):710-6. PubMed ID: 23240998 [TBL] [Abstract][Full Text] [Related]
14. Acid-base properties of xanthosine 5'-monophosphate (XMP) and of some related nucleobase derivatives in aqueous solution: micro acidity constant evaluations of the (N1)H versus the (N3)H deprotonation ambiguity. Massoud SS; Corfù NA; Griesser R; Sigel H Chemistry; 2004 Oct; 10(20):5129-37. PubMed ID: 15372679 [TBL] [Abstract][Full Text] [Related]
15. Surface residence and uptake of methyl chloride and methyl alcohol at the air/water interface studied by vibrational sum frequency spectroscopy and molecular dynamics. Harper K; Minofar B; Sierra-Hernandez MR; Casillas-Ituarte NN; Roeselova M; Allen HC J Phys Chem A; 2009 Mar; 113(10):2015-24. PubMed ID: 19195991 [TBL] [Abstract][Full Text] [Related]
16. A reliable and efficient first principles-based method for predicting pK(a) values. III. Adding explicit water molecules: can the theoretical slope be reproduced and pK(a) values predicted more accurately? Zhang S J Comput Chem; 2012 Feb; 33(5):517-26. PubMed ID: 22173939 [TBL] [Abstract][Full Text] [Related]
17. Molecular sinkers: X-ray photoemission and atomistic simulations of benzoic acid and benzoate at the aqueous solution/vapor interface. Ottosson N; Romanova AO; Söderström J; Björneholm O; Ohrwall G; Fedorov MV J Phys Chem B; 2012 Nov; 116(43):13017-23. PubMed ID: 22934651 [TBL] [Abstract][Full Text] [Related]