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The dynamics of peptide-water interactions in dialanine: An ultrafast amide I 2D IR and computational spectroscopy study

We present a joint experimental and computational study of the dynamic interactions of dialanine (Ala–Ala) with water, comparing the results of ultrafast 2D IR and infrared transient absorption spectroscopy of its amide I vibration with spectra modeled from molecular dynamics (MD) simulations. The e...

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Pubblicato in:J Chem Phys
Autori principali: Feng, Chi-Jui, Tokmakoff, Andrei
Natura: Artigo
Lingua:Inglês
Pubblicazione: AIP Publishing LLC 2017
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC5593305/
https://ncbi.nlm.nih.gov/pubmed/28863528
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4991871
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