GLYCAM06 a generalizable biomolecular force field. Carbohydrates

GLYCAM06 : a generalizable biomolecular force field. Carbohydrates

A new derivation of the GLYCAM06 force field, which removes its previous specificity for carbohydrates, and its dependency on the AMBER force field and parameters, is presented. All pertinent force field terms have been explicitly specified and so no default or generic parameters are employed. The n...

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Bibliographische Detailangaben
Veröffentlicht in:Journal of computational chemistry. - 1984. - 29(2008), 4 vom: 09. März, Seite 622-55
1. Verfasser: Kirschner, Karl N (VerfasserIn)
Weitere Verfasser: Yongye, Austin B, Tschampel, Sarah M, González-Outeiriño, Jorge, Daniels, Charlisa R, Foley, B Lachele, Woods, Robert J
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2008
Zugriff auf das übergeordnete Werk:Journal of computational chemistry
Schlagworte:Journal Article Research Support, N.I.H., Extramural Research Support, U.S. Gov't, Non-P.H.S. Alcohols Amides Carbohydrates Esters Ether 0F5N573A2Y