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Parametrization of backbone-electrostatic and multibody contributions to the UNRES force field for protein-structure prediction from Ab initio energy surfaces of model systems
- Source :
- Journal of Physical Chemistry B. July 8, 2004, Vol. 108 Issue 27, p9421, 18 p.
- Publication Year :
- 2004
-
Abstract
- Multibody terms pertaining to the correlation between electrostatic interaction in the UNRES force field were reparameterized on relevant model systems. The resultant force field predicted the structures of proteins with alpha and beta structure.
Details
- Language :
- English
- ISSN :
- 15206106
- Volume :
- 108
- Issue :
- 27
- Database :
- Gale General OneFile
- Journal :
- Journal of Physical Chemistry B
- Publication Type :
- Academic Journal
- Accession number :
- edsgcl.122841222