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A critical analysis of computational protein design with sparse residue interaction graphs

Protein design algorithms enumerate a combinatorial number of candidate structures to compute the Global Minimum Energy Conformation (GMEC). To efficiently find the GMEC, protein design algorithms must methodically reduce the conformational search space. By applying distance and energy cutoffs, the...

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Veröffentlicht in:PLoS Comput Biol
Hauptverfasser: Jain, Swati, Jou, Jonathan D., Georgiev, Ivelin S., Donald, Bruce R.
Format: Artigo
Sprache:Inglês
Veröffentlicht: Public Library of Science 2017
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Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5391103/
https://ncbi.nlm.nih.gov/pubmed/28358804
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1371/journal.pcbi.1005346
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