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.
96 related articles for article (PubMed ID: 9955492)
41. A Systematic Comparison of Second-Order Polarization Propagator Approximation (SOPPA) and Equation-of-Motion Coupled Cluster Singles and Doubles (EOM-CCSD) Spin-Spin Coupling Constants for Selected Singly Bonded Molecules, and the Hydrides NH3, H2O, and HF and Their Protonated and Deprotonated Ions and Hydrogen-Bonded Complexes. Del Bene JE; Alkorta I; Elguero J J Chem Theory Comput; 2008 Jun; 4(6):967-73. PubMed ID: 26621237 [TBL] [Abstract][Full Text] [Related]
42. Characterizing hydrogen bonding and proton transfer in 2:1 FH:NH3 and FH:collidine complexes through one- and two-bond spin-spin coupling constants across hydrogen bonds. Del Bene JE; Elguero J J Phys Chem A; 2005 Dec; 109(47):10759-69. PubMed ID: 16863125 [TBL] [Abstract][Full Text] [Related]
43. Systematic ab initio study of 15N-15N and 15N-1H spin-spin coupling constants across N-H+-N hydrogen bonds: predicting N-N and N-H coupling constants and relating them to hydrogen bond type. Del Bene JE; Elguero J J Phys Chem A; 2006 Jun; 110(23):7496-502. PubMed ID: 16759141 [TBL] [Abstract][Full Text] [Related]
44. Determination of sugar structures in solution from residual dipolar coupling constants: methodology and application to methyl beta-D-xylopyranoside. Pham TN; Hinchley SL; Rankin DW; Liptaj T; Uhrín D J Am Chem Soc; 2004 Oct; 126(40):13100-10. PubMed ID: 15469309 [TBL] [Abstract][Full Text] [Related]
46. Substitution and protonation effects on spin-spin coupling constants in prototypical aromatic rings: C6H6, C5H5N and C5H5P. Del Bene JE; Elguero J Magn Reson Chem; 2006 Aug; 44(8):784-9. PubMed ID: 16710849 [TBL] [Abstract][Full Text] [Related]
47. Approximating correlation effects in multiconfigurational self-consistent field calculations of spin-spin coupling constants. San Fabián J; Díez E; García de la Vega JM; Suardíaz R J Chem Phys; 2008 Feb; 128(8):084108. PubMed ID: 18315034 [TBL] [Abstract][Full Text] [Related]
48. Theoretical prediction and assignment of vicinal 1H-1H coupling constants of diastereomeric 3-alkoxy-6,7-epoxy-2-oxabicyclo[3.3.0]octanes. Aav R; Pehk T; Tamp S; Tamm T; Kudrjašova M; Parve O; Lopp M Magn Reson Chem; 2011 Feb; 49(2):76-82. PubMed ID: 21254228 [TBL] [Abstract][Full Text] [Related]
49. Ab initio study of the magnetic exchange coupling constants of a structural model [CaMn(3)(III)Mn(II)] of the oxygen evolving center in photosystem II. Fliegl H; Fink K; Klopper W; Anson CE; Powell AK; Clérac R Phys Chem Chem Phys; 2009 May; 11(20):3900-9. PubMed ID: 19440618 [TBL] [Abstract][Full Text] [Related]
50. A systematic comparison of second-order polarization propagator approximation and equation-of-motion coupled cluster singles and doubles C-C, C-N, N-N, C-H, and N-H spin-spin coupling constants. Del Bene JE; Alkorta I; Elguero J J Phys Chem A; 2009 Nov; 113(45):12411-20. PubMed ID: 19462958 [TBL] [Abstract][Full Text] [Related]
51. A general approach for determining scalar coupling constants in polypeptides and proteins. Montelione GT; Emerson SD; Lyons BA Biopolymers; 1992 Apr; 32(4):327-34. PubMed ID: 1623127 [TBL] [Abstract][Full Text] [Related]
52. Vicinal coupling constants and protein dynamics. Hoch JC; Dobson CM; Karplus M Biochemistry; 1985 Jul; 24(15):3831-41. PubMed ID: 4052369 [TBL] [Abstract][Full Text] [Related]
53. Spin-spin coupling constants transmitted through Ir-H...H-N dihydrogen bonds. Olejniczak M; Pecul M Chemphyschem; 2009 Jun; 10(8):1247-59. PubMed ID: 19418508 [TBL] [Abstract][Full Text] [Related]
54. Pushing resolution limits for extracting Zeng Q; Lin Y; Chen Z J Chem Phys; 2019 May; 150(18):184202. PubMed ID: 31091887 [TBL] [Abstract][Full Text] [Related]
55. Theoretical calculation of the NMR spin-spin coupling constants and the NMR shifts allow distinguishability between the specific direct and the water-mediated binding of a divalent metal cation to guanine. Sychrovský V; Sponer J; Hobza P J Am Chem Soc; 2004 Jan; 126(2):663-72. PubMed ID: 14719966 [TBL] [Abstract][Full Text] [Related]
56. The performance of hybrid density functional theory for the calculation of indirect nuclear spin-spin coupling constants in substituted hydrocarbons. Lutnaes OB; Ruden TA; Helgaker T Magn Reson Chem; 2004 Oct; 42 Spec no():S117-27. PubMed ID: 15366047 [TBL] [Abstract][Full Text] [Related]
58. Electronic influences on 3J(C,H) coupling constants via -S-, -S(O)- and -SO2-: their determination, calculation and comparison of detection methods. Heydenreich M; Koch A; Kovács J; Tóth G; Kleinpeter E Magn Reson Chem; 2004 Aug; 42(8):667-70. PubMed ID: 15248254 [TBL] [Abstract][Full Text] [Related]
59. Photoproduction of dissolved organic carbon and inorganic nutrients from resuspended lake sediments. Hu B; Wang P; Zhang N; Wang C; Ao Y Environ Sci Pollut Res Int; 2016 Nov; 23(21):22126-22135. PubMed ID: 27543128 [TBL] [Abstract][Full Text] [Related]