Coarse-grained simulation of cellulose Iβ with application to long fibrils

Cellulose

Volumn 22, Issue 1, 2015, Pages 31-44

  Fan, Bingxin ^a   Maranas, Janna K ^a  

^a The Pennsylvania State University   (United States)

Author keywords

Cellulose I ; Coarse grained simulation; Force field; Full length microfibril

Indexed keywords

CELLULOSE; CRYSTAL STRUCTURE; NEUTRON SCATTERING; VAN DER WAALS FORCES;

CELLULOSE I; COARSE-GRAINED; COARSE-GRAINED FORCE FIELDS; FORCE FIELDS; HYDROGEN BONDING INTERACTIONS; INTERMOLECULAR PACKING; LONGITUDINAL DIRECTION; MICROFIBRIL;

HYDROGEN BONDS;

EID: 84925496059     PISSN: 09690239     EISSN: 1572882X     Source Type: Journal    
DOI: 10.1007/s10570-014-0481-2     Document Type: Article

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