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On the molecular origin of the cooperative coil-to-globule transition of poly(N-isopropylacrylamide) in water

By means of atomistic molecular dynamics simulations we investigate the behaviour of poly(N-isopropylacrylamide), PNIPAM, in water at temperatures below and above the lower critical solution temperature (LCST), including the undercooled regime. The transition between water soluble and insoluble stat...

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Detalhes bibliográficos
Publicado no:Phys Chem Chem Phys
Main Authors: Tavagnacco, L., Zaccarelli, E., Chiessi, E.
Formato: Artigo
Idioma:Inglês
Publicado em: Royal Society of Chemistry 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5932979/
https://ncbi.nlm.nih.gov/pubmed/29619464
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c8cp00537k
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