Folded-chain structure of cellulose II suggested by molecular dynamics simulation

Carbohydrate Research

Volumn 379, Issue , 2013, Pages 30-37

  Yamane, Chihiro ^a   Miyamoto, Hitomi ^b   Hayakawa, Daichi ^b   Ueda, Kazuyoshi ^b  

^a KOBE WOMEN'S UNIVERSITY   (Japan)

^b YOKOHAMA NATIONAL UNIVERSITY   (Japan)

Author keywords

Folded chain; Molecular dynamics (MD) simulation; Molecular sheet; Regenerated cellulose; Ring conformation; Structure formation mechanism

Indexed keywords

BOATS; CELLULOSE; CHAINS; CONFORMATIONS; HYDROGEN BONDS; MOLECULAR DYNAMICS;

FOLDED CHAIN; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SHEETS; REGENERATED CELLULOSE; RING CONFORMATIONS; STRUCTURE FORMATIONS;

CRYSTAL STRUCTURE;

CELLULOSE; WATER;

ARTICLE; CONFORMATION; CRYSTAL STRUCTURE; ENERGY; HYDROGEN BOND; MOLECULAR DYNAMICS; MOLECULAR STABILITY; PRIORITY JOURNAL; SURFACE PROPERTY;

FOLDED CHAIN; MOLECULAR DYNAMICS (MD) SIMULATION; MOLECULAR SHEET; REGENERATED CELLULOSE; RING CONFORMATION; STRUCTURE FORMATION MECHANISM;

CARBOHYDRATE CONFORMATION; CELLULOSE; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION;

EID: 84884992651     PISSN: 00086215     EISSN: 1873426X     Source Type: Journal    
DOI: 10.1016/j.carres.2013.06.012     Document Type: Article

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