324 related articles for article (PubMed ID: 22449223)
1. Visualizing internal stabilization in weakly bound systems using atomic energies: hydrogen bonding in small water clusters.
Albrecht L; Boyd RJ
J Phys Chem A; 2012 Apr; 116(15):3946-51. PubMed ID: 22449223
[TBL] [Abstract][Full Text] [Related]
2. Ab initio study of hydrogen-bond formation between aliphatic and phenolic hydroxy groups and selected amino acid side chains.
Nagy PI; Erhardt PW
J Phys Chem A; 2008 May; 112(18):4342-54. PubMed ID: 18373368
[TBL] [Abstract][Full Text] [Related]
3. Hydrogen bond cooperativity in water hexamers: atomic energy perspective of local stabilities.
Albrecht L; Chowdhury S; Boyd RJ
J Phys Chem A; 2013 Oct; 117(41):10790-9. PubMed ID: 24067198
[TBL] [Abstract][Full Text] [Related]
4. Ab initio quantum mechanics analysis of imidazole C-H...O water hydrogen bonding and a molecular mechanics forcefield correction.
Ornstein RL; Zheng YJ
J Biomol Struct Dyn; 1997 Jun; 14(6):657-65. PubMed ID: 9195335
[TBL] [Abstract][Full Text] [Related]
5. Characterization of cooperative effects in linear alpha-glycylglycine clusters.
Bahrami A; Esrafili MD; Hadipour NL
Biophys Chem; 2009 Jul; 143(1-2):26-33. PubMed ID: 19383568
[TBL] [Abstract][Full Text] [Related]
6. Ab initio study of hydrogen-bond formation between cyclic ethers and selected amino acid side chains.
Nagy PI; Erhardt PW
J Phys Chem A; 2006 Dec; 110(51):13923-32. PubMed ID: 17181352
[TBL] [Abstract][Full Text] [Related]
7. Development of a 3-body:many-body integrated fragmentation method for weakly bound clusters and application to water clusters (H2O)(n = 3-10, 16, 17).
Bates DM; Smith JR; Janowski T; Tschumper GS
J Chem Phys; 2011 Jul; 135(4):044123. PubMed ID: 21806106
[TBL] [Abstract][Full Text] [Related]
8. Two-way effects between hydrogen bond and intramolecular resonance effect: an ab initio study on complexes of formamide and its derivatives with water.
Liu T; Li H; Huang MB; Duan Y; Wang ZX
J Phys Chem A; 2008 Jun; 112(24):5436-47. PubMed ID: 18503289
[TBL] [Abstract][Full Text] [Related]
9. A new scheme for determining the intramolecular seven-membered ring N-H...O=C hydrogen-bonding energies of glycine and alanine peptides.
Wang CS; Zhang Y; Gao K; Yang ZZ
J Chem Phys; 2005 Jul; 123(2):24307. PubMed ID: 16050745
[TBL] [Abstract][Full Text] [Related]
10. True stabilization energies for the optimal planar hydrogen-bonded and stacked structures of guanine...cytosine, adenine...thymine, and their 9- and 1-methyl derivatives: complete basis set calculations at the MP2 and CCSD(T) levels and comparison with experiment.
Jurecka P; Hobza P
J Am Chem Soc; 2003 Dec; 125(50):15608-13. PubMed ID: 14664608
[TBL] [Abstract][Full Text] [Related]
11. Water-benzene interactions: an effective fragment potential and correlated quantum chemistry study.
Slipchenko LV; Gordon MS
J Phys Chem A; 2009 Mar; 113(10):2092-102. PubMed ID: 19072625
[TBL] [Abstract][Full Text] [Related]
12. Mechanism of the hydration of carbon dioxide: direct participation of H2O versus microsolvation.
Nguyen MT; Matus MH; Jackson VE; Vu TN; Rustad JR; Dixon DA
J Phys Chem A; 2008 Oct; 112(41):10386-98. PubMed ID: 18816037
[TBL] [Abstract][Full Text] [Related]
13. Hydrogen bonding in phenol, water, and phenol-water clusters.
Parthasarathi R; Subramanian V; Sathyamurthy N
J Phys Chem A; 2005 Feb; 109(5):843-50. PubMed ID: 16838955
[TBL] [Abstract][Full Text] [Related]
14. Treatment of dilute clusters of methanol and water by ab initio quantum mechanical calculations.
Ruckenstein E; Shulgin IL; Tilson JL
J Phys Chem A; 2005 Feb; 109(5):807-15. PubMed ID: 16838951
[TBL] [Abstract][Full Text] [Related]
15. Characteristics of antiaromatic ring pi multi-hydrogen bonds in (H2O)n-C4H4 (n = 1, 2) complexes.
Jing YQ; Li ZR; Wu D; Li Y; Wang BQ; Sun CC
J Phys Chem A; 2006 Jun; 110(23):7470-6. PubMed ID: 16759137
[TBL] [Abstract][Full Text] [Related]
16. Theoretical study of negatively charged Fe(-)-(H2O)(n ≤ 6) clusters.
Castro M
J Phys Chem A; 2012 Jun; 116(23):5529-40. PubMed ID: 22607630
[TBL] [Abstract][Full Text] [Related]
17. On geometries of stacked and H-bonded nucleic acid base pairs determined at various DFT, MP2, and CCSD(T) levels up to the CCSD(T)/complete basis set limit level.
Dabkowska I; Jurecka P; Hobza P
J Chem Phys; 2005 May; 122(20):204322. PubMed ID: 15945739
[TBL] [Abstract][Full Text] [Related]
18. Charge-assisted intramolecular hydrogen bonds in disubstituted cyclohexane derivatives.
Lopes Jesus AJ; Redinha JS
J Phys Chem A; 2011 Dec; 115(48):14069-77. PubMed ID: 22026642
[TBL] [Abstract][Full Text] [Related]
19. Electron density characteristics in bond critical point (QTAIM) versus interaction energy components (SAPT): the case of charge-assisted hydrogen bonding.
Bankiewicz B; Matczak P; Palusiak M
J Phys Chem A; 2012 Jan; 116(1):452-9. PubMed ID: 22175651
[TBL] [Abstract][Full Text] [Related]
20. Comparison of hydrated hydroperoxide anion (HOO-)(H2O)n clusters with alkaline hydrogen peroxide (HOOH)(OH-)(H2O)(n-1) clusters, n = 1-8, 20: an ab initio study.
Anick DJ
J Phys Chem A; 2011 Jun; 115(24):6327-38. PubMed ID: 21604682
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
