This reports some Monte Carlo free energy results for a fluid of point dipoles embedded in had spheres. The multistage sampling method is compared with thermodynamic integration techniques, The resulting free energies are also compared with recent theoretical results obtained from the mean spherical
Metadynamic sampling of the free-energy landscapes of proteins coupled with a Monte Carlo algorithm
โ Scribed by F. Marini; C. Camilloni; D. Provasi; R.A. Broglia; G. Tiana
- Book ID
- 116508073
- Publisher
- Elsevier Science
- Year
- 2008
- Tongue
- English
- Weight
- 701 KB
- Volume
- 422
- Category
- Article
- ISSN
- 0378-1119
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