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Uncovering Differences in Hydration Free Energies and Structures for Model Compound Mimics of Charged Side Chains of Amino Acids

[Image: see text] Free energies of hydration are of fundamental interest for modeling and understanding conformational and phase equilibria of macromolecular solutes in aqueous phases. Of particular relevance to systems such as intrinsically disordered proteins are the free energies of hydration and...

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Detalles Bibliográficos
Autores principales: Fossat, Martin J., Zeng, Xiangze, Pappu, Rohit V.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8154595/
https://www.ncbi.nlm.nih.gov/pubmed/33877835
http://dx.doi.org/10.1021/acs.jpcb.1c01073