Structures of the xylose-water complex: Energetics, transitions between conformers and spectroscopy

Chemical Physics Letters

Volumn 518, Issue , 2011, Pages 49-54

  Jin, Lin ^a   Simons, John P ^b   Gerber, R Benny ^a,c  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b UNIVERSITY OF OXFORD   (United Kingdom)

^c HEBREW UNIVERSITY OF JERUSALEM   (Israel)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO MOLECULAR DYNAMICS SIMULATION; CRYOGENIC TEMPERATURES; EXPERIMENTAL DATA; LOW ENERGIES; POTENTIAL ENERGY LANDSCAPES; RAPID TRANSITIONS; SELF-CONSISTENT FIELD; STRUCTURAL ASSIGNMENTS; STRUCTURE OPTIMIZATION;

CALCULATIONS; ISOMERS; MOLECULAR DYNAMICS; POTENTIAL ENERGY;

STRUCTURAL OPTIMIZATION;

EID: 82555186949     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2011.11.008     Document Type: Article

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