CiteULike: BragilMassoud's mc [5 articles]

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	Conformational memories with variable bond angles. [My Copy] J Comput Chem (17 September 2007) by Robert M M. Whitnell, Dow P P. Hurst, Patricia H H. Reggio, Frank Guarnieri posted to conforamtions mc by BragilMassoud on 2007-09-20 13:45:43 as
	Accuracy of binding mode prediction with a cascadic stochastic tunneling method. [My Copy] Proteins (11 April 2007) by Bernhard Fischer, Serena Basili, Holger Merlitz, Wolfgang Wenzel posted to docking mc stun by BragilMassoud on 2007-04-22 16:52:42 as
	Docking small ligands in flexible binding sites [My Copy] Journal of Computational Chemistry, Vol. 19, No. 1. (1998), pp. 21-37. by Joannis Apostolakis, Andreas Plückthun, Amedeo Caflisch posted to docking flexible_protein mc minimization by BragilMassoud on 2007-03-05 13:48:11 as along with 3 people karinaecomp klexa schlauchi
	Reproducible protein folding with the stochastic tunneling method. [My Copy] Phys Rev Lett, Vol. 91, No. 15. (10 October 2003) by A. Schug, T. Herges, W. Wenzel posted to stun minimization mc by BragilMassoud on 2007-02-01 14:43:46 as
	Adaptation in stochastic tunneling global optimization of complex potential energy landscapes [My Copy] Europhysics Letters, Vol. 74, No. 6. (2006), 944. by K. Hamacher posted to stun minimization mc by BragilMassoud on 2007-02-01 14:42:25 as

docking	175
structure	91
protein	89
screening	84
pharmacology	43
energyfunctions	42
review	38
math	35
nma	25
affinity	22
kinases	21
forcefield	21
ligands	20
minimization	18
flexible_protein	18
robert	17
visualization	13
hts	13
md	13
db	13
internal_coordinates	12
superposition	11
alignment	11
actin	10
gold	9
electrostatics	9
evolution	8
ligand	7
kinesin	7
solvation	6
design	6
dehydron	6
specificity	5
cavities	5
stun	5
flexx	5
machinelearning	5
mc	5
surflex	5
statistics	5
evotrace	4
pts	4
glide	4
metabolomics	4
slide	4
conformations	4
qc	4
textmining	3
autodock	3
inversescreening	3
graphs	3
comment	3
ribbons	3
comparison	3
physics	3
benchmarks	3
est	3
sasa	3
antibiotics	3
roc	3
fingerprints	3
benchmark	3
brain	3
ga	2
born	2
ring_flipping	2
chemogenomics	2
pharmacogenetics	2
consensus	2
geneexpression	2
quaternion	2
ludi	2
abinitio	2
enzyme	2
enzymes	2
tox	2
database	2
similarity	2
graph	2
cancer	2
pharmacophore	2
energy_functions	2
pharmacolgy	1
fragmentation	1
optimization	1
networks	1
affinitiy	1
loop_quantum	1
antidepressants	1
ligandfit	1
conformaations	1
pharmacologyy	1
mechanics	1
adme	1
denovo	1
open_access	1
dock	1
density	1
hammerhead	1
pdk1	1
hond	1
pain	1
kinase	1
salvinorin	1
conformation	1
therapy	1
glamdock	1
rotation	1
ghb	1
neuro	1
bias	1
xray	1
metal	1
hydration	1
hom_model	1
ehits	1
psychology	1
spline	1
science	1
entropy	1
sequence	1
rss	1
bench_errors	1
qsar	1
geometry	1
gpu	1
framgents	1
openeye	1
dokcing	1
antoptimization	1
water	1
conforamtions	1
random	1
language	1
hbond	1
qxp	1
algorithm	1
inverse_screening	1
clustering	1
fragments	1
1acj	1
psychedelics	1

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