Molecular dynamics simulations of β-d-glucopyranose
✍ Scribed by John W. Brady
- Book ID
- 107725618
- Publisher
- Elsevier Science
- Year
- 1987
- Tongue
- English
- Weight
- 494 KB
- Volume
- 165
- Category
- Article
- ISSN
- 0008-6215
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📜 SIMILAR VOLUMES
Molecular dynamics simulations of -hairpin folding have been carried out with a solvent-referenced potential at 274 K. The model peptide V 4 D PGV 4 formed stable -hairpin conformations and the -hairpin ratio calculated by the DSSP algorithm was about 56% in the 50-ns simulation. Folding into -h
The crystal and molecular structure of potassium P-D-glucopyranose 6sulphate has been determined by direct methods. The sugar ring has the expected 4C1 conformation although the sulphate group causes flattening of the ring. The potassium ion has octahedral co-ordination involving oxygen atoms of fiv