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Experimentally assessing molecular dynamics sampling of the protein native state conformational distribution
The acute sensitivity to conformation exhibited by amide hydrogen exchange reactivity provides a valuable test for the physical accuracy of model ensembles developed to represent the Boltzmann distribution of the protein native state. A number of molecular dynamics studies of ubiquitin have predicte...
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| Autori principali: | , , |
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| Natura: | Artigo |
| Lingua: | Inglês |
| Pubblicazione: |
2012
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| Soggetti: | |
| Accesso online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3400181/ https://ncbi.nlm.nih.gov/pubmed/22425325 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpc.2012.02.002 |
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