Solvent-driven preferential association of lignin with regions of crystalline cellulose in molecular dynamics simulation

Biomacromolecules

Volumn 14, Issue 10, 2013, Pages 3390-3398

  Lindner, Benjamin ^a,b   Petridis, Loukas ^a   Schulz, Roland ^a,b   Smith, Jeremy C ^a,b  

^a OAK RIDGE NATIONAL LABORATORY   (United States)

^b UNIVERSITY OF TENNESSEE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CELLULOSE; CELLULOSIC ETHANOL; CRYSTALLINE MATERIALS; MOLECULAR DYNAMICS; PRECIPITATION (CHEMICAL);

CRYSTALLINE CELLULOSE; CRYSTALLINE REGIONS; ECONOMICALLY VIABLE; LIGNOCELLULOSIC BIOMASS; MOLECULAR DYNAMICS SIMULATIONS; NONCRYSTALLINE; NONEQUILIBRIUM MOLECULAR DYNAMICS SIMULATION; PRE-TREATMENT;

LIGNIN;

CELLULOSE; LIGNIN; LIGNOCELLULOSE; SOLVENT;

ADHESION; ALCOHOL PRODUCTION; AQUEOUS SOLUTION; ARTICLE; ATOMIC FORCE MICROSCOPY; BIOFUEL PRODUCTION; CHEMICAL COMPOSITION; CHEMICAL STRUCTURE; CONFORMATIONAL TRANSITION; CRYSTAL STRUCTURE; GLASS TRANSITION TEMPERATURE; HYDRATION; HYDROGEN BOND; HYDROLYSIS; HYDROPHILICITY; HYDROPHOBICITY; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; MOLECULAR WEIGHT; PRIORITY JOURNAL; SIMULATION; CHEMISTRY; CRYSTALLIZATION;

CELLULOSE; CRYSTALLIZATION; LIGNIN; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; SOLVENTS;

EID: 84885608176     PISSN: 15257797     EISSN: 15264602     Source Type: Journal    
DOI: 10.1021/bm400442n     Document Type: Article

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