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Density functional calculations of (15)N chemical shifts in solvated dipeptides
We performed density functional calculations to examine the effects of solvation, hydrogen bonding, backbone conformation, and the side chain on (15)N chemical shielding in proteins. We used N-methylacetamide (NMA) and N-formyl-alanyl-X (with X being one of the 19 naturally occurring amino acids exc...
Gorde:
| Egile Nagusiak: | , , |
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| Formatua: | Artigo |
| Hizkuntza: | Inglês |
| Argitaratua: |
2008
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| Gaiak: | |
| Sarrera elektronikoa: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2891059/ https://ncbi.nlm.nih.gov/pubmed/18484179 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10858-008-9241-7 |
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