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Le, Hongbiao, Oldfield, Eric (1996) Ab InitioStudies of Amide-15NChemical Shifts in Dipeptides:  Applications to Protein NMR Spectroscopy†. The Journal of Physical Chemistry, 100 (40). 16423-16428 doi:10.1021/jp9606164

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Reference TypeJournal (article/letter/editorial)
TitleAb InitioStudies of Amide-15NChemical Shifts in Dipeptides:  Applications to Protein NMR Spectroscopy†
JournalThe Journal of Physical Chemistry
AuthorsLe, HongbiaoAuthor
Oldfield, EricAuthor
Year1996 (January)Volume100
Issue40
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/jp9606164Search in ResearchGate
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Mindat Ref. ID8043771Long-form Identifiermindat:1:5:8043771:4
GUID0
Full ReferenceLe, Hongbiao, Oldfield, Eric (1996) Ab InitioStudies of Amide-15NChemical Shifts in Dipeptides:  Applications to Protein NMR Spectroscopy†. The Journal of Physical Chemistry, 100 (40). 16423-16428 doi:10.1021/jp9606164
Plain TextLe, Hongbiao, Oldfield, Eric (1996) Ab InitioStudies of Amide-15NChemical Shifts in Dipeptides:  Applications to Protein NMR Spectroscopy†. The Journal of Physical Chemistry, 100 (40). 16423-16428 doi:10.1021/jp9606164
In(1996, January) The Journal of Physical Chemistry Vol. 100 (40) American Chemical Society (ACS)

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de Dios, Angel C., Oldfield, Eric (1994) Ab Initio Study of the Effects of Torsion Angles on Carbon-13 Nuclear Magnetic Resonance Chemical Shielding in N-Formyl-L-alanine Amide, N-Formyl-L-valine Amide, and Some Simple Model Compounds: Applications to Protein NMR Spectroscopy. Journal Of The American Chemical Society, 116 (12) 5307-5314 doi:10.1021/ja00091a040
Havlin, Robert, McMahon, Michael, Srinivasan, Ranjani, Le, Hongbiao, Oldfield, Eric (1997) Solid-State NMR and Density Functional Investigation of Carbon-13 Shielding Tensors in Metal−Olefin Complexes†. The Journal of Physical Chemistry A, 101 (47). 8908-8913 doi:10.1021/jp972058e
Le, Hong-biao, Pearson, John G., de Dios, Angel C., Oldfield, Eric (1995) Protein Structure Refinement and Prediction via NMR Chemical Shifts and Quantum Chemistry. Journal Of The American Chemical Society, 117 (13) 3800-3807 doi:10.1021/ja00118a016
Zhang, Yong, Oldfield, Eric (2006) 31P NMR Chemical Shifts in Hypervalent Oxyphosphoranes and Polymeric Orthophosphates. The Journal of Physical Chemistry B, 110 (1). 579-586 doi:10.1021/jp054022p
Ornellas, Fernando R., Iwata, Suehiro (1996) Ab InitioStudies of Silicon and Nitrogen Clusters:  Cyclic or Linear Si2N?. The Journal of Physical Chemistry, 100 (26). 10919-10927 doi:10.1021/jp960255s
Cheng, Feng, Sun, Haihong, Zhang, Yong, Mukkamala, Dushyant, Oldfield, Eric (2005) A Solid State13C NMR, Crystallographic, and Quantum Chemical Investigation of Chemical Shifts and Hydrogen Bonding in Histidine Dipeptides. Journal Of The American Chemical Society, 127 (36) 12544-12554 doi:10.1021/ja051528c
Pearson, John G., Le, Hongbiao, Sanders, Lori K., Godbout, Nathalie, Havlin, Robert H., Oldfield, Eric (1997) Predicting Chemical Shifts in Proteins:  Structure Refinement of Valine Residues by Usingab Initioand Empirical Geometry Optimizations†. Journal Of The American Chemical Society, 119 (49) 11941-11950 doi:10.1021/ja971461w
Roa, Guillermo, Ugalde, Jesus M., Cossío, Fernando P. (1996) Ab InitioStudies on the Structure of Silyl Isocyanate in the Gas Phase, in Solution, and in the Crystalline State. The Journal of Physical Chemistry, 100 (23). 9619-9623 doi:10.1021/jp9530764
Walter, Thomas H., Reven, Linda, Oldfield, Eric (1989) Magic-angle spinning carbon-13 NMR spectroscopy of transition-metal carbonyl clusters. The Journal of Physical Chemistry, 93 (4). 1320-1326 doi:10.1021/j100341a029
Zhang, Yong, Oldfield, Eric (2008) NMR Hyperfine Shifts in Blue Copper Proteins:  A Quantum Chemical Investigation. Journal Of The American Chemical Society, 130 (12) 3814-3823 doi:10.1021/ja075978b
Pearson, John G., Wang, Jin-Feng, Markley, John L., Le, Hong-biao, Oldfield, Eric (1995) Protein Structure Refinement Using Carbon-13 Nuclear Magnetic Resonance Spectroscopic Chemical Shifts and Quantum Chemistry. Journal Of The American Chemical Society, 117 (34) 8823-8829 doi:10.1021/ja00139a016
 
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