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Molecular Dynamics of a 15-Residue Poly( l -alanine) in Water: Helix Formation and Energetics

✍ Scribed by Takano, Mitsunori; Yamato, Takahisa; Higo, Junichi; Suyama, Akira; Nagayama, Kuniaki


Book ID
126963294
Publisher
American Chemical Society
Year
1999
Tongue
English
Weight
178 KB
Volume
121
Category
Article
ISSN
0002-7863

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Molecular dynamics simulation of the sta
✍ Aldert R. Van Buuren; Herman J. C. Berendsen 📂 Article 📅 1993 🏛 Wiley (John Wiley & Sons) 🌐 English ⚖ 627 KB

## Abstract A molecular dynamics (MD) simulation was performed on the α‐helix H8‐HC5, the C‐terminal part of myoglobin (residue 132–153), under periodic boundary conditions in two different solutions, water and water with 30% (v/v) 2,2,2‐trifluoroethanol (TFE), at 300 K to investigate the stability