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pH-Induced Changes in Polypeptide Conformation: Force-Field Comparison with Experimental Validation
[Image: see text] Microsecond-long all-atom molecular dynamics (MD) simulations, circular dichroism, laser Doppler velocimetry, and dynamic light-scattering techniques have been used to investigate pH-induced changes in the secondary structure, charge, and conformation of poly l-lysine (PLL) and pol...
Autores principales: | Batys, Piotr, Morga, Maria, Bonarek, Piotr, Sammalkorpi, Maria |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical
Society
2020
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7590956/ https://www.ncbi.nlm.nih.gov/pubmed/32182068 http://dx.doi.org/10.1021/acs.jpcb.0c01475 |
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