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Molecular Dynamics Ensemble Refinement of Intrinsically Disordered Peptides According to Deconvoluted Spectra from Circular Dichroism
We have developed a computational method of atomistically refining the structural ensemble of intrinsically disordered peptides (IDPs) facilitated by experimental measurements using circular dichroism spectroscopy (CD). A major challenge surrounding this approach stems from the deconvolution of expe...
Autores principales: | Ezerski, Jacob C., Zhang, Pengzhi, Jennings, Nathaniel C., Waxham, M. Neal, Cheung, Margaret S. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Biophysical Society
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7136346/ https://www.ncbi.nlm.nih.gov/pubmed/32145192 http://dx.doi.org/10.1016/j.bpj.2020.02.015 |
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