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Improved side-chain prediction accuracy using an ab initio potential energy function and a very large rotamer library

Accurate prediction of the placement and comformations of protein side chains given only the backbone trace has a wide range of uses in protein design, structure prediction, and functional analysis. Prediction has most often relied on discrete rotamer libraries so that rapid fitness of side-chain ro...

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Detalhes bibliográficos
Main Authors: Peterson, Ronald W., Dutton, P. Leslie, Wand, A. Joshua
Formato: Artigo
Idioma:Inglês
Publicado em: Cold Spring Harbor Laboratory Press 2004
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2286725/
https://ncbi.nlm.nih.gov/pubmed/14978310
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1110/ps.03250104
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