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Density functional calculations of chemical shielding of backbone (15)N in helical residues of protein G

We performed density functional calculations of backbone (15)N chemical shielding tensors in selected helical residues of protein G. Here we describe a computationally efficient methodology to include most of the important effects in the calculation of chemical shieldings of backbone (15)N. We analy...

詳細記述

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書誌詳細
主要な著者: Cai, Ling, Fushman, David, Kosov, Daniel S.
フォーマット: Artigo
言語:Inglês
出版事項: 2009
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC2884268/
https://ncbi.nlm.nih.gov/pubmed/19644655
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10858-009-9358-3
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