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Factors affecting the ability of energy functions to discriminate correct from incorrect folds

✍ Scribed by Britt H. Park; Enoch S. Huang; Michael Levitt


Book ID
115627747
Publisher
Elsevier Science
Year
1997
Tongue
English
Weight
321 KB
Volume
266
Category
Article
ISSN
0022-2836

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Free-energy function for discriminating
✍ Satoshi Yasuda; Takashi Yoshidome; Yuichi Harano; Roland Roth; Hiraku Oshima; Ko πŸ“‚ Article πŸ“… 2011 πŸ› John Wiley and Sons 🌐 English βš– 688 KB

## Abstract In this study, free‐energy function (FEF) for discriminating the native fold of a protein from misfolded decoys was investigated. It is a physics‐based function using an all‐atom model, which comprises the hydration entropy (HE) and the total dehydration penalty (TDP). The HE is calcula