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Sulfation and Calcium Favor Compact Conformations of Chondroitin in Aqueous Solutions

[Image: see text] The effects of sulfation and calcium cations (Ca(2+)) on the atomic-resolution conformational properties of chondroitin carbohydrate polymers in aqueous solutions are not well studied owing to experimental challenges. Here, we compare all-atom explicit-solvent molecular dynamics si...

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Detalles Bibliográficos
Autores principales: Guvench, Olgun, Whitmore, Elizabeth K.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8158799/
https://www.ncbi.nlm.nih.gov/pubmed/34056470
http://dx.doi.org/10.1021/acsomega.1c01071