CiteULike: LamBras's Costanzi:S [2 articles]

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flexibility	61
md	61
serinracemase	58
nmda	58
docking	53
virtual_screening	45
adme	30
drugdesign	26
review	19
scoring	18
cheminformatics	14
trna	13
bayesian	12
muscarinic	12
free_energy	12
sidechain	12
ion_channels	12
library_design	10
homology_modeling	9
targeted_md	8
normal_modes	8
nr1	7
rotamers	7
sar	7
conformers	6
gpcr	6
xray	5
forcefield	5
clustering	5
nmr	5
herg	4
surface	4
water_replacement	4
proteins	4
druglike	4
alzheimer	3
hts	3
fingerprints	3
ensemble	3
chemicalspace	3
scaffoldhopping	3
shape	2
similarity	2
correlation	2
racemase	2
lipophilicity	2
dynamics	2
mmpbsa	2
hd	2
graph	2
pipelining	2
validation	1
allosteric	1
x-ray	1
denovo	1
r1	1
induced_fit	1
schroedinger	1
de_novo	1
qsar	1
ppb	1
m1m2	1
virtuak_screening	1
itc	1

	Ligand and structure-based methodologies for the prediction of the activity of G protein-coupled receptor ligands [My Copy] Journal of Computer-Aided Molecular Design by Stefano Costanzi, Irina Tikhonova, T. Harden, Kenneth Jacobson posted to docking gpcr homology_modeling sar virtual_screening by LamBras on 2008-09-16 12:42:59 as
	On the Applicability of GPCR Homology Models to Computer-Aided Drug Discovery: A Comparison between In Silico and Crystal Structures of the β2-Adrenergic Receptor [My Copy] Journal of Medicinal Chemistry, Vol. 51, No. 10. (1 May 2008), pp. 2907-2914. by Stefano Costanzi posted to gpcr homology_modeling by LamBras on 2008-08-14 10:49:43 as

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