171 related articles for article (PubMed ID: 18543984)
21. An exploration of mechanisms for the transformation of 8-oxoguanine to guanidinohydantoin and spiroiminodihydantoin by density functional theory.
Munk BH; Burrows CJ; Schlegel HB
J Am Chem Soc; 2008 Apr; 130(15):5245-56. PubMed ID: 18355018
[TBL] [Abstract][Full Text] [Related]
22. 5-cyanoimino-4-oxomethylene-4,5-dihydroimidazole and nitrosative guanine deamination. A theoretical study of geometries, electronic structures, and N-protonation.
Rayat S; Glaser R
J Org Chem; 2003 Dec; 68(26):9882-92. PubMed ID: 14682679
[TBL] [Abstract][Full Text] [Related]
23. Effect of substituents and conformations on the optical rotations of cyclic oxides and related compounds. relationship between the anomeric effect and optical rotation.
Wiberg KB; Wilson SM; Wang YG; Vaccaro PH; Cheeseman JR; Luderer MR
J Org Chem; 2007 Aug; 72(16):6206-14. PubMed ID: 17628107
[TBL] [Abstract][Full Text] [Related]
24. Tautomeric equilibrium, stability, and hydrogen bonding in 2'-deoxyguanosine monophosphate complexed with Mg2+.
Kosenkov D; Gorb L; Shishkin OV; Sponer J; Leszczynski J
J Phys Chem B; 2008 Jan; 112(1):150-7. PubMed ID: 18069814
[TBL] [Abstract][Full Text] [Related]
25. Characterizing radiation-induced oxidation of DNA by way of the monohydrated guanine-cytosine radical cation.
Jaeger HM; Schaefer HF
J Phys Chem B; 2009 Jun; 113(23):8142-8. PubMed ID: 19445496
[TBL] [Abstract][Full Text] [Related]
26. Ab initio studies of aspartic acid conformers in gas phase and in solution.
Chen M; Lin Z
J Chem Phys; 2007 Oct; 127(15):154314. PubMed ID: 17949156
[TBL] [Abstract][Full Text] [Related]
27. Ab initio study of 2,4-substituted azolidines. II. Amino-imino tautomerism of 2-aminothiazolidine-4-one and 4-aminothiazolidine-2-one in water solution.
Enchev V; Markova N; Angelova S
J Phys Chem A; 2005 Oct; 109(39):8904-13. PubMed ID: 16834294
[TBL] [Abstract][Full Text] [Related]
28. Theoretical analysis of gas-phase front-side attack identity S(N)2(C) and S(N)2(Si) reactions with retention of configuration.
Yang ZZ; Ding YL; Zhao DX
J Phys Chem A; 2009 May; 113(18):5432-45. PubMed ID: 19354223
[TBL] [Abstract][Full Text] [Related]
29. Investigation of base pairs containing oxidized guanine using ab initio method and ABEEMσπ polarizable force field.
Liu C; Wang Y; Zhao D; Gong L; Yang Z
J Mol Graph Model; 2014 Feb; 47():62-76. PubMed ID: 24322440
[TBL] [Abstract][Full Text] [Related]
30. Highly accurate CCSD(T) and DFT-SAPT stabilization energies of H-bonded and stacked structures of the uracil dimer.
Pitonák M; Riley KE; Neogrády P; Hobza P
Chemphyschem; 2008 Aug; 9(11):1636-44. PubMed ID: 18574830
[TBL] [Abstract][Full Text] [Related]
31. Solvation model induced structural changes in peptides. A quantum chemical study on Ramachandran surfaces and conformers of alanine diamide using the polarizable continuum model.
Hudáky I; Hudáky P; Perczel A
J Comput Chem; 2004 Sep; 25(12):1522-31. PubMed ID: 15224396
[TBL] [Abstract][Full Text] [Related]
32. Ionization of purine tautomers in nucleobases, nucleosides, and nucleotides: from the gas phase to the aqueous environment.
Pluharrová E; Jungwirth P; Bradforth SE; Slavícek P
J Phys Chem B; 2011 Feb; 115(5):1294-305. PubMed ID: 21247073
[TBL] [Abstract][Full Text] [Related]
33. Reorganization energy, activation energy, and mechanism of hole transfer process in DNA: a theoretical study.
Khan A
J Chem Phys; 2008 Feb; 128(7):075101. PubMed ID: 18298173
[TBL] [Abstract][Full Text] [Related]
34. Evaluation of the enthalpy of formation, proton affinity, and gas-phase basicity of gamma-butyrolactone and 2-pyrrolidinone by isodesmic reactions.
Vessecchi R; Galembeck SE
J Phys Chem A; 2008 May; 112(17):4060-6. PubMed ID: 18380497
[TBL] [Abstract][Full Text] [Related]
35. Nitrosative guanine deamination: ab initio study of deglycation of N-protonated 5-cyanoimino-4-oxomethylene-4,5-dihydroimidazoles.
Rayat S; Wu Z; Glaser R
Chem Res Toxicol; 2004 Sep; 17(9):1157-69. PubMed ID: 15377149
[TBL] [Abstract][Full Text] [Related]
36. Model transition states for methane diazonium ion methylation of guanine runs in oligomeric DNA.
Ekanayake KS; Lebreton PR
J Comput Chem; 2007 Nov; 28(14):2352-65. PubMed ID: 17476668
[TBL] [Abstract][Full Text] [Related]
37. Protection against radiation-induced DNA damage by amino acids: a DFT study.
Jena NR; Mishra PC; Suhai S
J Phys Chem B; 2009 Apr; 113(16):5633-44. PubMed ID: 19334703
[TBL] [Abstract][Full Text] [Related]
38. 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]
39. Ab initio kinetic simulation of gas-phase experiments: tautomerization of cytosine and guanine.
Kosenkov D; Kholod Y; Gorb L; Shishkin O; Hovorun DM; Mons M; Leszczynski J
J Phys Chem B; 2009 Apr; 113(17):6140-50. PubMed ID: 19351126
[TBL] [Abstract][Full Text] [Related]
40. CL-20 photodecomposition: ab initio foundations for identification of products.
Kholod Y; Kosenkov D; Okovytyy S; Gorb L; Qasim M; Leszczynski J
Spectrochim Acta A Mol Biomol Spectrosc; 2008 Nov; 71(1):230-7. PubMed ID: 18262832
[TBL] [Abstract][Full Text] [Related]
[Previous] [Next] [New Search]
