Performance of density functional models to reproduce observed (13)C(alpha) chemical shifts of proteins in solution

Performance of density functional models to reproduce observed (13)C(alpha) chemical shifts of proteins in solution

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http://www.wikidata.org/entity/Q30371932
What can we learn by computing 13Calpha chemical shifts for X-ray protein models?My 65 years in protein chemistryProCS15: a DFT-based chemical shift predictor for backbone and Cβ atoms in proteins.A simple graphical approach to predict local residue conformation using NMR chemical shifts and density functional theory.Assessing the fractions of tautomeric forms of the imidazole ring of histidine in proteins as a function of pH.Rapid calculation of protein chemical shifts using bond polarization theory and its application to protein structure refinement.Sequential nearest-neighbor effects on computed 13Calpha chemical shifts.Factors affecting the computation of the 13C shielding in disaccharides.Assessing the accuracy of protein structures by quantum mechanical computations of 13C(alpha) chemical shifts.Fermentation and Cost-Effective 13C/15N Labeling of the Nonribosomal Peptide Gramicidin S for Nuclear Magnetic Resonance Structure Analysis.
P2860

Performance of density functional models to reproduce observed (13)C(alpha) chemical shifts of proteins in solution

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http://www.wikidata.org/entity/Q30371932
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2009 nî lūn-bûn
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2009 թուականի Ապրիլին հրատարակուած գիտական յօդուած
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2009 թվականի ապրիլին հրատարակված գիտական հոդված
@hy
2009年の論文
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2009年論文
@yue
2009年論文
@zh-hant
2009年論文
@zh-hk
2009年論文
@zh-mo
2009年論文
@zh-tw
2009年论文
@wuu
name
Performance of density functio ...... shifts of proteins in solution
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Performance of density functio ...... shifts of proteins in solution
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type
label
Performance of density functio ...... shifts of proteins in solution
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Performance of density functio ...... shifts of proteins in solution
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prefLabel
Performance of density functio ...... shifts of proteins in solution
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Performance of density functio ...... shifts of proteins in solution
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P1433
P1476
P2093
P2860
P304
P31
P356
P433
P478
P50
P577
P5875
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P932
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Performance of density functio ...... shifts of proteins in solution
@en
P2093
P2860
P304
P31
P356
P433
P478
P50
P577
P5875
P698
P921
P932