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Equilibrium Ensembles for Insulin Folding from Bias-Exchange Metadynamics
Earliest events in the aggregation process, such as single molecule reconfiguration, are extremely important and the most difficult to characterize in experiments. To this end, we have used well-tempered bias exchange metadynamics simulations to determine the equilibrium ensembles of an insulin mole...
में बचाया:
| में प्रकाशित: | Biophys J |
|---|---|
| मुख्य लेखकों: | , , , |
| स्वरूप: | Artigo |
| भाषा: | Inglês |
| प्रकाशित: |
The Biophysical Society
2017
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| विषय: | |
| ऑनलाइन पहुंच: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5406382/ https://ncbi.nlm.nih.gov/pubmed/28445749 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.bpj.2017.03.015 |
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