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  • Currently displaying 19441 - 19460 of 29270 publications
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Chemical markup, XML, and the world wide web. 6. CMLReact, an XML vocabulary for chemical reactions.
GL Holliday, P Murray-Rust, HS Rzepa
Journal of chemical information and modeling
(2005)
46
Dynamic Effects in MAS and MQMAS NMR Spectra of Half-Integer Quadrupolar Nuclei:  Calculations and an Application to the Double Perovskite Cryolite
M Kotecha, S Chaudhuri, CP Grey, L Frydman
J Am Chem Soc
(2005)
127
Asymmetric organocatalytic conjugate addition of malonates to enones using a proline tetrazole catalyst
KR Knudsen, CET Mitchell, SV Ley
Chemical communications (Cambridge, England)
(2005)
A combinatorial approach to the electron correlation problem
AJW Thom, A Alavi
The Journal of chemical physics
(2005)
123
Cellular logic with orthogonal ribosomes
O Rackham, JW Chin
Journal of the American Chemical Society
(2005)
127
Screening for crystalline salts via mechanochemistry
AV Trask, DA Haynes, WDS Motherwell, W Jones
Chemical communications (Cambridge, England)
(2005)
Investigating the latent polymorphism of maleic acid
GM Day, AV Trask, WDS Motherwell, W Jones
Chemical communications (Cambridge, England)
(2005)
Spectral properties of disordered fully connected graphs
SN Taraskin
Phys Rev E Stat Nonlin Soft Matter Phys
(2005)
72
One-dimensional zinc-based coordination polymers incorporating cyanate anions.
AD Bond, CJ McKenzie
Acta Crystallogr C
(2005)
61
Synthesis of a Novel Cyclic Donor−Acceptor Conjugate for Selective Recognition of ATP
PP Neelakandan, M Hariharan, D Ramaiah
Organic letters
(2005)
7
Molybdenum carbonyl complexes with pyridylimino acidato ligands.
R García-Rodríguez, D Miguel
Dalton Transactions
(2005)
6
Delayed-focus pulses for magnetic resonance imaging: an evolutionary approach.
XL Wu, P Xu, R Freeman
Magnetic Resonance in Medicine
(2005)
20
Defects in signal transduction caused by a T cell receptor beta chain substitution.
TA Reno, S Ley, E Sugiyama, A Cantagrel, R Blumberg, J Bonventre, C Terhorst, ET Yeh
Eur J Immunol
(2005)
20
Probing the pressure-temperature stability of amyloid fibrils provides new insights into their molecular properties
F Meersman, CM Dobson
Biochimica et Biophysica Acta
(2005)
1764
Novel structural motifs in clusters of dipolar spheres: Knots, links, and coils
MA Miller, DJ Wales
Journal of Physical Chemistry B
(2005)
109
Assessment of a Coulomb-attenuated exchange–correlation energy functional
MJG Peach, T Helgaker, P Sałek, TW Keal, OB Lutnaes, DJ Tozer, NC Handy
Phys Chem Chem Phys
(2005)
8
Computer-assisted design of asymmetric 1,3-dipolar cycloadditions between dimethylvinylborane and chiral nitrones
J Díaz, MA Silva, JM Goodman, SC Pellegrinet
Tetrahedron
(2005)
61
Structure, conformational stability, and enzymatic properties of acylphosphatase from the hyperthermophile Sulfolobus solfataricus
A Corazza, C Rosano, K Pagano, V Alverdi, G Esposito, C Capanni, F Bemporad, G Plakoutsi, M Stefani, F Chiti, S Zuccotti, M Bolognesi, P Viglino
Proteins Structure Function and Bioinformatics
(2005)
62
Global minima for water clusters (H2O) , n⩽ 21, described by a five-site empirical potential
T James, DJ Wales, J Hernández-Rojas
Chemical Physics Letters
(2005)
415
Critical influence of adsorption geometry in the heterogeneous epoxidation of "allylic" alkenes: Structure and reactivity of three phenylpropene isomers on Cu(111)
FJ Williams, RL Cropley, OPH Vaughan, AJ Urquhart, MS Tikhov, C Kolczewski, K Hermann, RM Lambert
Journal of the American Chemical Society
(2005)
127