Theoretical investigation of the ultrafast dissociation of ionised biomolecules immersed in water: Direct and indirect effects

Mutation Research - Reviews in Mutation Research

Volumn 704, Issue 1-3, 2010, Pages 45-53

  Gaigeot, M P ^a   Lopez Tarifa, P ^b   Martin, F ^b   Alcami, M ^b   Vuilleumier, R ^c   Tavernelli, I ^d   Herve du Penhoat M A ^e   Politis, M F ^e  

^a UNIVERSITÉ D EVRY VAL D ESSONNE   (France)

^b UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^c ECOLE NORMALE SUPÉRIEURE   (France)

^d INSTITUTE OF CHEMICAL SCIENCES AND ENGINEERING   (Switzerland)

^e UNIVERSITÉ PIERRE ET MARIE CURIE   (France)

Author keywords

Density functional calculations; DNA damage; Femto chemistry; Ionisation in liquids; Molecular dynamics; Radiolysis; Swift heavy ion tracks; TD DFT; Wannier orbitals; Water

Indexed keywords

DNA; IONIC LIQUID; OXYGEN; RADICAL; RNA; URACIL;

ATOM; CHEMICAL REACTION; DENSITY FUNCTIONAL THEORY; DISSOCIATION; DNA DAMAGE; ELECTRON RADIATION; HEAVY ION RADIATION; IONIZING RADIATION; MOLECULAR DYNAMICS; MOLECULE; PRIORITY JOURNAL; REVIEW; VELOCITY; WATER IMMERSION;

COMPUTATIONAL BIOLOGY; DNA DAMAGE; HEAVY IONS; IMMERSION; MODELS, THEORETICAL; MOLECULAR DYNAMICS SIMULATION; OXYGEN; RADIATION, IONIZING; URACIL; WATER;

EID: 77952092866     PISSN: 13835742     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.mrrev.2010.01.004     Document Type: Review

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