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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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Detalhes bibliográficos
Publicado no:J Phys Chem B
Main Authors: Fossat, Martin J., Zeng, Xiangze, Pappu, Rohit V.
Formato: Artigo
Idioma:Inglês
Publicado em: American Chemical Society 2021
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8154595/
https://ncbi.nlm.nih.gov/pubmed/33877835
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.1c01073
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