250 related articles for article (PubMed ID: 19708119)
41. Hydrogen peroxide clusters: the role of open book motif in cage and helical structures.
Elango M; Parthasarathi R; Subramanian V; Ramachandran CN; Sathyamurthy N
J Phys Chem A; 2006 May; 110(19):6294-300. PubMed ID: 16686465
[TBL] [Abstract][Full Text] [Related]
42. Density functional theory-symmetry adapted perturbation treatment energy decomposition of nucleic acid base pairs taken from DNA crystal geometry.
Sedlák R; Jurecka P; Hobza P
J Chem Phys; 2007 Aug; 127(7):075104. PubMed ID: 17718635
[No Abstract] [Full Text] [Related]
43. Toward the exact solution of the electronic Schrödinger equation for noncovalent molecular interactions: worldwide distributed quantum monte carlo calculations.
Korth M; Lüchow A; Grimme S
J Phys Chem A; 2008 Mar; 112(10):2104-9. PubMed ID: 18201073
[TBL] [Abstract][Full Text] [Related]
44. Red-shifted hydrogen bonds and blue-shifted van der Waals contact in the standard Watson-Crick adenine-thymine base pair.
Zhou PP; Qiu WY
J Phys Chem A; 2009 Sep; 113(38):10306-20. PubMed ID: 19715282
[TBL] [Abstract][Full Text] [Related]
45. Hydrogen-abstracted adenine-thymine radicals with interesting transferable properties.
Lind MC; Richardson NA; Wheeler SE; Schaefer HF
J Phys Chem B; 2007 May; 111(19):5525-30. PubMed ID: 17458994
[TBL] [Abstract][Full Text] [Related]
46. Effects of hydration on the proton transfer mechanism in the adenine-thymine base pair.
Cerón-Carrasco JP; Requena A; Michaux C; Perpète EA; Jacquemin D
J Phys Chem A; 2009 Jul; 113(27):7892-8. PubMed ID: 19569720
[TBL] [Abstract][Full Text] [Related]
47. An ab initio benchmark study of hydrogen bonded formamide dimers.
Frey JA; Leutwyler S
J Phys Chem A; 2006 Nov; 110(45):12512-8. PubMed ID: 17091957
[TBL] [Abstract][Full Text] [Related]
48. Exceptional thermodynamic stability of DNA duplexes modified by nonpolar base analogues is due to increased stacking interactions and favorable solvation: Correlated ab initio calculations and molecular dynamics simulations.
Reha D; Hocek M; Hobza P
Chemistry; 2006 Apr; 12(13):3587-95. PubMed ID: 16502452
[TBL] [Abstract][Full Text] [Related]
49. Theoretical investigation of the coupling between hydrogen-atom transfer and stacking interaction in adenine-thymine dimers.
Villani G
Chemphyschem; 2013 Apr; 14(6):1256-63. PubMed ID: 23494877
[TBL] [Abstract][Full Text] [Related]
50. High-Order Quantum-Mechanical Analysis of Hydrogen Bonding in Hachimoji and Natural DNA Base Pairs.
Kumawat RL; Sherrill CD
J Chem Inf Model; 2023 May; 63(10):3150-3157. PubMed ID: 37125692
[TBL] [Abstract][Full Text] [Related]
51. Trans Hoogsteen/sugar edge base pairing in RNA. Structures, energies, and stabilities from quantum chemical calculations.
Mládek A; Sharma P; Mitra A; Bhattacharyya D; Sponer J; Sponer JE
J Phys Chem B; 2009 Feb; 113(6):1743-55. PubMed ID: 19152254
[TBL] [Abstract][Full Text] [Related]
52. Protonation of base pairs in RNA: context analysis and quantum chemical investigations of their geometries and stabilities.
Chawla M; Sharma P; Halder S; Bhattacharyya D; Mitra A
J Phys Chem B; 2011 Feb; 115(6):1469-84. PubMed ID: 21254753
[TBL] [Abstract][Full Text] [Related]
53. Measurement and theory of hydrogen bonding contribution to isosteric DNA base pairs.
Khakshoor O; Wheeler SE; Houk KN; Kool ET
J Am Chem Soc; 2012 Feb; 134(6):3154-63. PubMed ID: 22300089
[TBL] [Abstract][Full Text] [Related]
54. Structures and energetics of the deprotonated adenine-uracil base pair, including proton-transferred systems.
Kim S; Lind MC; Schaefer HF
J Phys Chem B; 2008 Mar; 112(11):3545-51. PubMed ID: 18303886
[TBL] [Abstract][Full Text] [Related]
55. Homopairing possibilities of the DNA base adenine.
Kelly RE; Lee YJ; Kantorovich LN
J Phys Chem B; 2005 Jun; 109(24):11933-9. PubMed ID: 16852470
[TBL] [Abstract][Full Text] [Related]
56. Hydrogen-bonding-induced shifts of the excitation energies in nucleic acid bases: an interplay between electrostatic and electron density overlap effects.
Wesolowski TA
J Am Chem Soc; 2004 Sep; 126(37):11444-5. PubMed ID: 15366883
[TBL] [Abstract][Full Text] [Related]
57. Ab initio base-pairing energies of uracil and 5-hydroxyuracil with standard DNA bases at the BSSE-free DFT and MP2 theory levels.
Volk DE; Thiviyanathan V; Somasunderam A; Gorenstein DG
Org Biomol Chem; 2006 May; 4(9):1741-5. PubMed ID: 16633566
[TBL] [Abstract][Full Text] [Related]
58. 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]
59. Amine-hydrogen halide complexes: experimental electric dipole moments and a theoretical decomposition of dipole moments and binding energies.
Brauer CS; Craddock MB; Kilian J; Grumstrup EM; Orilall MC; Mo Y; Gao J; Leopold KR
J Phys Chem A; 2006 Aug; 110(33):10025-34. PubMed ID: 16913676
[TBL] [Abstract][Full Text] [Related]
60. At nonzero temperatures, stacked structures of methylated nucleic acid base pairs and microhydrated nonmethylated nucleic acid base pairs are favored over planar hydrogen-bonded structures: a molecular dynamics simulations study.
Kabelác M; Hobza P
Chemistry; 2001 May; 7(10):2067-74. PubMed ID: 11411979
[TBL] [Abstract][Full Text] [Related]
[Previous] [Next] [New Search]
