Optimizing Solute-Solute Interactions in the GLYCAM06 and CHARMM36 Carbohydrate Force Fields Using Osmotic Pressure Measurements

Journal of Chemical Theory and Computation

Volumn 12, Issue 4, 2016, Pages 1401-1407

  Lay, Wesley K ^a   Miller, Mark S ^a   Elcock, Adrian H ^a  

^a UNIVERSITY OF IOWA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CARBOHYDRATE; DEXTRAN; GLUCOSE; SUCROSE;

CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; MOLECULAR MODEL; OSMOSIS; OSMOTIC PRESSURE; SOFTWARE; THERMODYNAMICS;

CARBOHYDRATES; COMPUTER SIMULATION; DEXTRANS; GLUCOSE; MODELS, CHEMICAL; MODELS, MOLECULAR; OSMOSIS; OSMOTIC PRESSURE; SOFTWARE; SUCROSE; THERMODYNAMICS;

EID: 84964624195     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/acs.jctc.5b01136     Document Type: Article

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