449 related articles for article (PubMed ID: 15099092)
1. Investigation of the NMR spin-spin coupling constants across the hydrogen bonds in ubiquitin: the nature of the hydrogen bond as reflected by the coupling mechanism.
Tuttle T; Kraka E; Wu A; Cremer D
J Am Chem Soc; 2004 Apr; 126(16):5093-107. PubMed ID: 15099092
[TBL] [Abstract][Full Text] [Related]
2. Electric field effects on one-bond indirect spin-spin coupling constants and possible biomolecular perspectives.
Sahakyan AB; Shahkhatuni AG; Shahkhatuni AA; Panosyan HA
J Phys Chem A; 2008 Apr; 112(16):3576-86. PubMed ID: 18363392
[TBL] [Abstract][Full Text] [Related]
3. 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]
4. Ab initio EOM-CCSD spin-spin coupling constants for hydrogen-bonded formamide complexes: bridging complexes with NH3, (NH3)2, H2O, (H2O)2, FH, and (FH)2.
Del Bene JE; Alkorta I; Elguero J
J Phys Chem A; 2008 Jul; 112(28):6338-43. PubMed ID: 18570358
[TBL] [Abstract][Full Text] [Related]
5. Decomposition of nuclear magnetic resonance spin-spin coupling constants into active and passive orbital contributions.
Gräfenstein J; Tuttle T; Cremer D
J Chem Phys; 2004 Jun; 120(21):9952-68. PubMed ID: 15268014
[TBL] [Abstract][Full Text] [Related]
6. Different types of hydrogen bonds in 2-substituted pyrroles and 1-vinyl pyrroles as monitored by (1)H, (13)C and (15)N NMR spectroscopy and ab initio calculations.
Afonin AV; Ushakov IA; Sobenina LN; Stepanova ZV; Petrova OV; Trofimov BA
Magn Reson Chem; 2006 Jan; 44(1):59-65. PubMed ID: 16259054
[TBL] [Abstract][Full Text] [Related]
7. 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]
8. Elucidation of the electronic structure of molecules with the help of NMR spin-spin coupling constants: the FH molecule.
Gräfenstein J; Tuttle T; Cremer D
J Phys Chem A; 2005 Mar; 109(10):2325-39. PubMed ID: 16839003
[TBL] [Abstract][Full Text] [Related]
9. One-electron versus electron-electron interaction contributions to the spin-spin coupling mechanism in nuclear magnetic resonance spectroscopy: analysis of basic electronic effects.
Gräfenstein J; Cremer D
J Chem Phys; 2004 Dec; 121(24):12217-32. PubMed ID: 15606240
[TBL] [Abstract][Full Text] [Related]
10. 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]
11. Calculation and analysis of NMR spin-spin coupling constants.
Cremer D; Gräfenstein J
Phys Chem Chem Phys; 2007 Jun; 9(22):2791-816. PubMed ID: 17538726
[TBL] [Abstract][Full Text] [Related]
12. NMR and DFT analysis of trisaccharide from heparin repeating sequence.
Hricovíni M; Driguez PA; Malkina OL
J Phys Chem B; 2014 Oct; 118(41):11931-42. PubMed ID: 25254635
[TBL] [Abstract][Full Text] [Related]
13. An NMR and relativistic DFT investigation of one-bond nuclear spin-spin coupling in solid triphenyl group-14 chlorides.
Willans MJ; Demko BA; Wasylishen RE
Phys Chem Chem Phys; 2006 Jun; 8(23):2733-43. PubMed ID: 16763706
[TBL] [Abstract][Full Text] [Related]
14. Predicted signs of reduced two-bond spin-spin coupling constants (2hKX-Y) across X-H-Y hydrogen bonds.
Del Bene JE; Elguero J
Magn Reson Chem; 2004 May; 42(5):421-3. PubMed ID: 15095377
[TBL] [Abstract][Full Text] [Related]
15. 1-Cyclohepta-2,4,6-trienyl-selanes--a 77Se NMR study: indirect nuclear 77Se--13C spin-spin coupling constants and application of density functional theory (DFT) calculations.
Wrackmeyer B; Hernández ZG; Herberhold M
Magn Reson Chem; 2007 Mar; 45(3):198-204. PubMed ID: 17183533
[TBL] [Abstract][Full Text] [Related]
16. 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]
17. NMR scalar coupling constant reveals that intraprotein hydrogen bonds are dynamically stabilized by electronic polarization.
Ji CG; Zhang JZ
J Phys Chem B; 2009 Oct; 113(42):13898-900. PubMed ID: 19791787
[TBL] [Abstract][Full Text] [Related]
18. Electron bridging dihydrogen bond in the imidazole-contained anion derivatives.
Yan S; Bu Y; Cukier RI
J Chem Phys; 2006 Mar; 124(12):124314. PubMed ID: 16599681
[TBL] [Abstract][Full Text] [Related]
19. Theoretical study of the scalar coupling constants across the noncovalent contacts in RNA base pairs: the cis- and trans-watson-crick/sugar edge base pair family.
Vokacova Z; Sponer J; Sponer JE; Sychrovský V
J Phys Chem B; 2007 Sep; 111(36):10813-24. PubMed ID: 17713941
[TBL] [Abstract][Full Text] [Related]
20. Can one assess the pi character of a C-C bond with the help of the NMR spin-spin coupling constants?
Cremer D; Kraka E; Wu A; Lüttke W
Chemphyschem; 2004 Mar; 5(3):349-66. PubMed ID: 15067872
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]