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Accuracy in determining interproton distances using Nuclear Overhauser Effect data from a flexible molecule

The determination of accurate NOE-derived interproton distances and confirmation/prediction of relative populations in multi-conformer, flexible small molecules was investigated with the model compound 4-propylaniline. The low accuracy assumed for semi-quantitative NOE distance restraints is typical...

Deskribapen osoa

Gorde:
Xehetasun bibliografikoak
Egile Nagusiak: Jones, Catharine R, Butts, Craig P, Harvey, Jeremy N
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: Beilstein-Institut 2011
Gaiak:
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC3063066/
https://ncbi.nlm.nih.gov/pubmed/21448257
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3762/bjoc.7.20
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