dfgreen's carbohydrate [6 articles] Export

Recent papers added to dfgreen's library classified by the tag carbohydrate. You can also see everyone's carbohydrate.

	Carbohydrate solution simulations: producing a force field with experimentally consistent primary alcohol rotational frequencies and populations. [My Copy] Journal of computational chemistry, Vol. 23, No. 13. (October 2002), pp. 1236-1243. by M. Kuttel, J. W. Brady, K. J. Naidoo posted to carbohydrate force-fields by dfgreen on 2009-01-08 22:39:23 as
	Carbohydrate conformation in aqueous solution: calculation of a QM/MM potential of mean force☆ [My Copy] Chemical Physics Letters, Vol. 388, No. 4-6. (21 April 2004), pp. 473-478. by A. Muslim, R. Bryce posted to ab-initio carbohydrate conformational preferences quantum-mechanics by dfgreen on 2009-01-08 20:52:38 as
	Is There a Generalized Reverse Anomeric Effect? Substituent and Solvent Effects on the Configurational Equilibria of Neutral and Protonated N-Arylglucopyranosylamines and N-Aryl-5-thioglucopyranosylamines† [My Copy] The Journal of Organic Chemistry, Vol. 65, No. 1. (1 January 2000), pp. 220-226. by Karla D. Randell, Blair D. Johnston, David F. Green, Mario B. Pinto posted to carbohydrate conformational preferences by dfgreen on 2009-01-07 23:21:22 as
	Conformational preferences in glycosylamines. implications for the exo-anomeric effect. [My Copy] Carbohydrate research, Vol. 330, No. 3. (15 February 2001), pp. 421-426. by R. J. Batchelor, D. F. Green, B. D. Johnston, B. O. Patrick, B. M. Pinto posted to carbohydrate conformational preferences by dfgreen on 2009-01-07 21:01:36 as
	Optimized parameters for continuum solvation calculations with carbohydrates. [My Copy] The journal of physical chemistry. B, Vol. 112, No. 16. (24 April 2008), pp. 5238-5249. by D. F. Green posted to carbohydrate electrostatics by dfgreen on 2009-01-07 20:28:09 as along with 2 people and 1 group flbarroso sobolevnrm baker-group
	Computational models explain the oligosaccharide specificity of cyanovirin-N. [My Copy] Protein science : a publication of the Protein Society, Vol. 17, No. 11. (November 2008), pp. 2008-2014. by Y. K. Fujimoto, R. N. Terbush, V. Patsalo, D. F. Green posted to binding carbohydrate electrostatics ligand specificity by dfgreen on 2009-01-07 20:24:42 as

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file-import-09-01-07b	274
electrostatics	96
protein	90
design	63
dynamics	47
molecular	47
ligand	46
solvation	44
binding	39
packing	19
quantum-mechanics	19
charges	18
optimization	18
free-energy	17
interactions	17
pka	17
review	17
perturbation	16
ab-initio	15
force-fields	15
generalized-born	13
hydrophobic	13
engineering	11
protein-protein	11
software	11
specificity	9
stability	9
poisson-boltzmann	7
structure	7
biopharmaceuticals	6
carbohydrate	6
conformational	6
docking	5
enzyme	5
biology	4
catalysis	4
dna	4
homology	4
preferences	4
sequence	4
systems	4
entropy	3
kinetics	3
linear-programming	3
quadratic-programming	3
semi-empirical	3
continuum-vdw	2
monte-carlo	2
protonation	2
rna	2
structure-prediction	2
visualization	2
water	2
action-at-a-distance	1
allostery	1
analysis	1
atp	1
brownian	1
calmodulin	1
dissociation	1
effect	1
electrochemistry	1
folding	1
g-protein	1
harmonics	1
hierarchicies	1
mean-field	1
membrane-association	1
phylogeny	1
proteomics	1
resistance	1
rna-protein	1
senstivity	1
text	1
vibrational	1

dfgreen's carbohydrate [6 articles] Export

dfgreen's tags