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- Currently displaying 18841 - 18860 of 29291 publications
PHYS 593-Diabatic free energy curves from vertical gap energies: An ab initio molecular dynamics approach
ABSTR PAP AM CHEM S
(2006)
232
"Bayes affinity fingerprints" improve retrieval rates in virtual screening and define orthogonal bioactivity space: when are multitarget drugs a feasible concept?
J Chem Inf Model
(2006)
46
2445
(doi: 10.1021/ci600197y)
Controllable growth of vertically aligned zinc oxide nanowires using vapour deposition
Nanotechnology
(2006)
17
4811
(doi: 10.1088/0957-4484/17/19/005)
Introduction: Conditions for the emergence of life on the early Earth.
Philosophical transactions of the Royal Society of London. Series B, Biological sciences
(2006)
361
1675
(doi: 10.1098/rstb.2006.1895)
The relaxation of OH (v=1) and OD (v=1) by H2O and D2O at temperatures from 251 to 390 K
Phys Chem Chem Phys
(2006)
8
4563
(doi: 10.1039/b609330b)
Bis(2,2′,2′′-nitrilotriethanol)cobalt(II) bis(acetate)
Acta Crystallographica Section E: Crystallographic Communications
(2006)
62
M2429
(doi: 10.1107/s160053680603443x)
Di-μ-chloro-bis({methyl [N,N-bis(2-pyridylmethyl)amino]acetate-κ4 N,N′,N′′,O}copper(II))bis(perchlorate) monohydrate
Acta Crystallographica Section E Structure Reports Online
(2006)
62
M2455
(doi: 10.1107/s1600536806034908)
Di-μ-chloro-bis{[N,N-bis(2-pyridylmethyl)glycine-κ4N,N′,N′′,O]copper(II)] diperchlorate acetonitrile tetrasolvate
Acta Crystallographica Section E: Crystallographic Communications
(2006)
62
M2453
(doi: 10.1107/S1600536806034003)
Enantioselective catalytic intramolecular cyclopropanation using modified cinchona alkaloid organocatalysts
Angewandte Chemie International Edition
(2006)
45
6024
(doi: 10.1002/anie.200602129)
8,9,10,10a-Tetrahydro-6H-tetrazolo[1,5-a]pyrrolo[2,1-c]pyrazines: New Heterocyclic Frameworks Generated by an Ugi-Type Multicomponent Reaction
Synthesis
(2006)
2006
3215
(doi: 10.1055/s-2006-950219)
Glass transition temperature of glucose, sucrose, and trehalose: An experimental and in silico study
Journal of Physical Chemistry B
(2006)
110
19678
(doi: 10.1021/jp063134t)
Sequence and structural determinants of amyloid fibril formation.
Accounts of Chemical Research
(2006)
39
620
(doi: 10.1021/ar050067x)
Synthesis of crown ether complexes of alkali-metallated organophosphine oxides and insertion reactions with isonitriles
Journal of Organometallic Chemistry
(2006)
691
3938
Hydrogen bonds at metal surfaces: Universal scaling and quantification of substrate effects
Surface Science
(2006)
600
224
(doi: 10.1016/j.susc.2006.05.053)
Synthesis and enzyme activity of SiO2 monolithic carrier with double-pore structure by addition of starch/PEG
Wuji Cailiao Xuebao Journal of Inorganic Materials
(2006)
21
1154
Copper catalyzed oxidation of organozinc halides.
Chem Commun (Camb)
(2006)
3883
(doi: 10.1039/b610218b)
Hydroxylamine as an Oxygen Nucleophile. Structure and Reactivity of Ammonia Oxide
J Am Chem Soc
(2006)
128
12374
(doi: 10.1021/ja065147q)
Polymer size in dilute solutions in the good-solvent regime
J Chem Phys
(2006)
125
094904
(doi: 10.1063/1.2339015)
Virial coefficients and osmotic pressure in polymer solutions in good-solvent conditions
J Chem Phys
(2006)
125
094903
(doi: 10.1063/1.2338913)
Efficient visible light-active N-doped TiO2 photocatalysts by a reproducible and controllable synthetic route
Chem. Commun.
(2006)
4236
(doi: 10.1039/b610316b)
