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  • Currently displaying 21661 - 21680 of 30663 publications
Author(s)
Publication title
Journal Name
Publication year
Floating liquid phase in sedimenting colloid-polymer mixtures.
M Schmidt, M Dijkstra, J-P Hansen
Physical review letters
(2004)
93
Similarity Searching of Chemical Databases Using Atom Environment Descriptors (MOLPRINT 2D): Evaluation of Performance
A Bender, HY Mussa, RC Glen, S Reiling
J Chem Inf Comput Sci
(2004)
44
Formation of an interlocked quadruplex dimer by d(GGGT)
Y Krishnan-Ghosh, D Liu, S Balasubramanian
Journal of the American Chemical Society
(2004)
126
A FORTRAN-90 Low-Energy Electron Diffraction program (LEED90 v1.1)
M Blanco-Rey, P de Andres, G Held, DA King
Computer Physics Communications
(2004)
161
Molecular t-matrices for Low-Energy Electron Diffraction (TMOL v1.1)
M Blanco-Rey, P de Andres, G Held, DA King
Computer Physics Communications
(2004)
161
Driving forces for self-organized coadsorption: C-6-H-6/2O and C-6-H-6/2CO on Ni{111}
S Yamagishi, SJ Jenkins, DA King
J Am Chem Soc
(2004)
126
Ordered block-copolymer assembly using nanoimprint lithography
H-W Li, WTS Huck
Nano Letters
(2004)
4
The formation of dimeric phosph(III)azane macrocycles [[P(mu-NtBu)]2.LL]2 [LL = organic spacer].
F García, RA Kowenicki, I Kuzu, L Riera, M McPartlin, DS Wright
Dalton transactions (Cambridge, England : 2003)
(2004)
5-tert-Butyl-2-(N,N-di­methyl­amino­carbonyl­thio)­isophthal­aldehyde
C McKenzie, AD Bond
Acta Crystallographica Section E: Crystallographic Communications
(2004)
60
Conformational sampling and dynamics of membrane proteins from 10-nanosecond computer simulations.
JD Faraldo-Gómez, LR Forrest, M Baaden, PJ Bond, C Domene, G Patargias, J Cuthbertson, MSP Sansom
Proteins: Structure, Function, and Bioinformatics
(2004)
57
Hartree-Fock exchange in time dependent density functional theory: Application to charge transfer excitations in solvated molecular systems
L Bernasconi, M Sprik, J Hutter
Chemical Physics Letters
(2004)
394
Combined neutron diffraction, NMR, and electrochemical investigation of the layered-to-spinel transformation in LiMnO2
AR Armstrong, N Dupre, AJ Paterson, CP Grey, PG Bruce
Chemistry of Materials
(2004)
16
A concise total synthesis of (+)-okaramine C.
PR Hewitt, E Cleator, SV Ley
Organic & Biomolecular Chemistry
(2004)
2
Forced peptide synthesis in nanoscale confinement under elastomeric stamps.
TP Sullivan, ML van Poll, PYW Dankers, WTS Huck
Angewandte Chemie International Edition
(2004)
43
Sulfonium Ylide Epoxidation Reactions: Methylene Transfer.
BR Bellenie, JM Goodman
ChemInform
(2004)
35
Rhodium(I) and palladium(II) complexes with the Schiff base 2,2'-bis((4S)-4-benzyl-2-oxazoline)
MD Jones, FAA Paz, JE Davies, R Raja, M Duer, J Klinowski, BFG Johnson
Inorganica Chimica Acta
(2004)
357
Crystal nucleation of colloidal suspensions under shear.
R Blaak, S Auer, D Frenkel, H Löwen
Phys Rev Lett
(2004)
93
The steady-state of heterogeneous catalysis, studied by first-principles statistical mechanics
K Reuter, D Frenkel, M Scheffler
(2004)
Liquid Water from First Principles: Investigation of Different Sampling Approaches
I-FW Kuo, CJ Mundy, MJ McGrath, JI Siepmann, J VandeVondele, M Sprik, J Hutter, B Chen, ML Klein, F Mohamed, M Krack, M Parrinello
Journal of Physical Chemistry B
(2004)
108
Synthesis and acid catalyzed hydrolysis of B-2,B-5 type conformationally constrained glucopyranosides: incorporation into a cellobiose analogue
Y Blériot, SK Vadivel, AJ Herrera, IR Greig, AJ Kirby, P Sinaÿ
Tetrahedron
(2004)
60