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Restriction versus guidance in protein structure prediction

Conformational restriction by fragment assembly and guidance in molecular dynamics are alternate conformational search strategies in protein structure prediction. We examine both approaches using a version of the associative memory Hamiltonian that incorporates the influence of water-mediated intera...

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Hauptverfasser: Hegler, Joseph A., Lätzer, Joachim, Shehu, Amarda, Clementi, Cecilia, Wolynes, Peter G.
Format: Artigo
Sprache:Inglês
Veröffentlicht: National Academy of Sciences 2009
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Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC2741246/
https://ncbi.nlm.nih.gov/pubmed/19706384
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0907002106
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