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dfgreen's Merz:KM [3 articles] Export

Recent papers posted to dfgreen's library by the author Merz:KM. You can also see everyone's Merz:KM.

	Atomic charges derived from semiempirical methods [My Copy] Journal of Computational Chemistry, Vol. 11, No. 4. (1990), pp. 431-439. by Brent H. Besler, Kenneth M. Merz, Peter A. Kollman posted to charges quantum-mechanics semi-empirical by dfgreen on 2009-01-08 23:36:06 as along with 1 person and 1 group A_Coletta_Thesis Structural Biology Group TorVergata
	A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules [My Copy] Journal of the American Chemical Society, Vol. 117, No. 19. (1 May 1995), pp. 5179-5197. by Wendy D. Cornell, Piotr Cieplak, Christopher I. Bayly, et al.Ian R. Gould, Kenneth M. Merz, David M. Ferguson, David C. Spellmeyer, Thomas Fox, James W. Caldwell, Peter A. Kollman posted to force-fields by dfgreen on 2009-01-08 22:31:13 as along with 6 people Lombardo_7 softsimu coomteng flbarroso kgutwin pavanghatty
	Determination of pKas of ionizable groups in proteins: the pKa of Glu 7 and 35 in hen eggs white lysozyme and Glu 106 in human carbonic anhydrase II [My Copy] Journal of the American Chemical Society, Vol. 113, No. 9. (1 April 1991), pp. 3572-3575. by Kenneth M. Merz posted to no-tag by dfgreen on 2009-01-08 18:12:39 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
pka	17
interactions	17
review	17
perturbation	16
ab-initio	15
force-fields	15
generalized-born	13
hydrophobic	13
protein-protein	11
engineering	11
software	11
stability	9
specificity	9
structure	7
poisson-boltzmann	7
conformational	6
biopharmaceuticals	6
carbohydrate	6
enzyme	5
docking	5
catalysis	4
sequence	4
biology	4
preferences	4
systems	4
dna	4
homology	4
linear-programming	3
kinetics	3
entropy	3
semi-empirical	3
quadratic-programming	3
protonation	2
water	2
monte-carlo	2
visualization	2
structure-prediction	2
continuum-vdw	2
rna	2
folding	1
membrane-association	1
vibrational	1
calmodulin	1
phylogeny	1
resistance	1
hierarchicies	1
mean-field	1
rna-protein	1
harmonics	1
g-protein	1
dissociation	1
brownian	1
proteomics	1
analysis	1
action-at-a-distance	1
effect	1
atp	1
allostery	1
electrochemistry	1
text	1
senstivity	1

dfgreen's Merz:KM [3 articles] Export

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