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Comparison of Knowledge-Based and Distance Geometry Approaches for Generation of Molecular Conformations

✍ Scribed by Feuston, B.P.; Miller, M.D.; Culberson, J.C.; Nachbar, R.B.; Kearsley, S.K.


Book ID
126894351
Publisher
American Chemical Society
Year
2001
Tongue
English
Weight
134 KB
Volume
41
Category
Article
ISSN
0095-2338

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## Synopsis A cyclic peptide analogue of somatostatin, including the o-aminomethylphenylacetic acid spacer, was studied by the combined use of two-dimensional nmr spectroscopy, distance geometry, and restrained molecular dynamics. Analysis of distances determined from nuclear Overhauser effect (NO