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International Journal of Mass Spectrometry

Volumn 308, Issue 2-3, 2011, Pages 281-288

N-H+ vibrational anharmonicities directly revealed from DFT-based molecular dynamics simulations on the Ala7H+ protonated peptide

(3) Sediki, Amel a Snoek, Lavina C b Gaigeot, Marie Pierre a,c

a UNIVERSITÉ D EVRY VAL D ESSONNE (France)

b UNIVERSITY OF OXFORD (United Kingdom)

c INSTITUT UNIVERSITAIRE DE FRANCE (France)

Author keywords

DFT based molecular dynamics; Gas phase; Infrared spectroscopy; IRMPD; Peptide; Vibrational anharmonicity

Indexed keywords

EID: 80955135037 PISSN: 13873806 EISSN: None Source Type: Journal
DOI: 10.1016/j.ijms.2011.06.016 Document Type: Article

Times cited : (30)

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