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Application of charge density methods to a protein model compound: Calculation of Coulombic intermolecular interaction energies from the experimental charge density
A combined experimental and theoretical charge density study of the pentapeptide Boc-Gln-d-Iva-Hyp-Ala-Phol (Boc, butoxycarbonyl; Gln, glutamine; Iva, isovaline; Hyp, hydroxyproline; Ala, ethylalanine; Phol, phenylalaninol) is described. The experimental analysis, based on synchrotron x-ray data col...
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| Hauptverfasser: | , , , , |
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| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
National Academy of Sciences
2002
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC129410/ https://ncbi.nlm.nih.gov/pubmed/12221293 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.192438999 |
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