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John Brady
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Biomass recalcitrance: engineering plants and enzymes for biofuels production
ME Himmel, SY Ding, DK Johnson, WS Adney, MR Nimlos, JW Brady, ...
science 315 (5813), 804-807, 2007
49942007
Additive empirical force field for hexopyranose monosaccharides
O Guvench, SN Greene, G Kamath, JW Brady, RM Venable, RW Pastor, ...
Journal of computational chemistry 29 (15), 2543-2564, 2008
5732008
Computer simulation studies of microcrystalline cellulose Iβ
JF Matthews, CE Skopec, PE Mason, P Zuccato, RW Torget, J Sugiyama, ...
Carbohydrate research 341 (1), 138-152, 2006
4572006
Hydrolysis of cellulose and hemicellulose
CE Wyman, SR Decker, ME Himmel, JW Brady, CE Skopec, L Viikari
Polysaccharides: Structural diversity and functional versatility 1, 1023-1062, 2005
3962005
A revised potential-energy surface for molecular mechanics studies of carbohydrates
SN Ha, A Giammona, M Field, JW Brady
Carbohydrate research 180 (2), 207-221, 1988
3731988
Carbohydrate solution simulations: producing a force field with experimentally consistent primary alcohol rotational frequencies and populations
M Kuttel, JW Brady, KJ Naidoo
Journal of computational chemistry 23 (13), 1236-1243, 2002
3382002
The structure of aqueous guanidinium chloride solutions
PE Mason, GW Neilson, JE Enderby, ML Saboungi, CE Dempsey, ...
Journal of the American Chemical Society 126 (37), 11462-11470, 2004
2942004
The role of hydrogen bonding in carbohydrates: molecular dynamics simulations of maltose in aqueous solution
JW Brady, RK Schmidt
The Journal of Physical Chemistry 97 (4), 958-966, 1993
2431993
Computer modeling of carbohydrate molecules
AD French, JW Brady
American Chemical Society, 1990
218*1990
Simulation studies of the insolubility of cellulose
M Bergenstrňhle, J Wohlert, ME Himmel, JW Brady
Carbohydrate research 345 (14), 2060-2066, 2010
2122010
Molecular dynamics simulations of. alpha.-D-glucose in aqueous solution
JW Brady
Journal of the American Chemical Society 111 (14), 5155-5165, 1989
2061989
Molecular dynamics studies of the hydration of α, α-trehalose
Q Liu, RK Schmidt, B Teo, PA Karplus, JW Brady
Journal of the American Chemical Society 119 (33), 7851-7862, 1997
1941997
Solvent effect on the anomeric equilibrium in D-glucose: a free energy simulation analysis
S Ha, J Gao, B Tidor, JW Brady, M Karplus
Journal of the American Chemical Society 113 (5), 1553-1557, 1991
1821991
Conformational analysis and molecular dynamics simulations of maltose
SN Ha, LJ Madsen, JW Brady
Biopolymers 27 (12), 1927-1952, 1988
1801988
Reversible dehydration of trehalose and anhydrobiosis: from solution state to an exotic crystal?
F Sussich, C Skopec, J Brady, A CesÓro
Carbohydrate Research 334 (3), 165-176, 2001
1672001
Comparison of cellulose Iβ simulations with three carbohydrate force fields
JF Matthews, GT Beckham, M Bergenstråhle-Wohlert, JW Brady, ...
Journal of Chemical Theory and Computation 8 (2), 735-748, 2012
1462012
High-temperature behavior of cellulose I
JF Matthews, M Bergenstråhle, GT Beckham, ME Himmel, MR Nimlos, ...
The Journal of Physical Chemistry B 115 (10), 2155-2166, 2011
1462011
Anisotropic solvent structuring in aqueous sugar solutions
Q Liu, JW Brady
Journal of the American Chemical Society 118 (49), 12276-12286, 1996
1391996
The anomeric equilibrium in D-xylose: free energy and the role of solvent structuring
RK Schmidt, M Karplus, JW Brady
Journal of the American Chemical Society 118 (3), 541-546, 1996
1381996
Molecular dynamics simulations of. alpha.-D-glucose
JW Brady
Journal of the American Chemical Society 108 (26), 8153-8160, 1986
1321986
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