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Protein Structure Prediction by Tempering Spatial Constraints

The probability to predict correctly a protein structure can be enhanced through introduction of spatial constraints - either from NMR experiments or from homologous structures. However, the additional constraints lead often to new local energy minima and worse sampling efficiency in simulations. In...

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Détails bibliographiques
Auteurs principaux: Gront, Dominik, Kolinski, Andrzej, Hansmann, Ulrich H.E.
Format: Artigo
Langue:Inglês
Publié: 2005
Sujets:
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC1473033/
https://ncbi.nlm.nih.gov/pubmed/16267688
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-005-9016-0
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