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- Currently displaying 21381 - 21400 of 30391 publications
Similarity Searching of Chemical Databases Using Atom Environment Descriptors (MOLPRINT 2D): Evaluation of Performance
J Chem Inf Comput Sci
(2004)
44
1708
(doi: 10.1021/ci0498719)
Formation of an Interlocked Quadruplex Dimer by d(GGGT)
J Am Chem Soc
(2004)
126
11009
(doi: 10.1021/ja049259y)
A FORTRAN-90 Low-Energy Electron Diffraction program (LEED90 v1.1)
Computer Physics Communications
(2004)
161
151
(doi: 10.1016/j.cpc.2004.05.002)
Molecular t-matrices for Low-Energy Electron Diffraction (TMOL v1.1)
Computer Physics Communications
(2004)
161
166
(doi: 10.1016/j.cpc.2004.05.003)
Driving forces for self-organized coadsorption: C6H 6/2O and C6H6/2CO on Ni{111}
Journal of the American Chemical Society
(2004)
126
10962
(doi: 10.1021/ja048589y)
The formation of dimeric phosph(iii)azane macrocycles [{P(µ-NtBu)}2·LL]2[LL = organic spacer]
Dalton Trans
(2004)
2904
(doi: 10.1039/B409071C)
Ordered block-copolymer assembly using nanoimprint lithography
Nano Letters
(2004)
4
1633
(doi: 10.1021/nl049209r)
5-tert-Butyl-2-(N,N-dimethylaminocarbonylthio)isophthalaldehyde
Acta Crystallographica Section E: Crystallographic Communications
(2004)
60
o1525
(doi: 10.1107/S1600536804019233)
Conformational sampling and dynamics of membrane proteins from 10-nanosecond computer simulations.
Proteins
(2004)
57
783
(doi: 10.1002/prot.20257)
Hartree-Fock exchange in time dependent density functional theory: application to charge transfer excitations in solvated molecular systems
Chemical Physics Letters
(2004)
394
141
(doi: 10.1016/j.cplett.2004.06.121)
Combined neutron diffraction, NMR, and electrochemical investigation of the layered-to-spinel transformation in LiMnO2
Chemistry of Materials
(2004)
16
{3106-3118}
(doi: 10.1021/cm034964b)
A concise total synthesis of (+)-okaramine C
Organic & Biomolecular Chemistry
(2004)
2
2415
(doi: 10.1039/B410180D)
Forced peptide synthesis in nanoscale confinement under elastomeric stamps.
Angewandte Chemie (International ed. in English)
(2004)
43
4190
(doi: 10.1002/anie.200460271)
Sulfonium Ylide Epoxidation Reactions: Methylene Transfer.
ChemInform
(2004)
35
no
(doi: 10.1002/chin.200435027)
Rhodium(I) and palladium(II) complexes with the Schiff base 2,2'-bis((4S)-4-benzyl-2-oxazoline)
Inorganica Chimica Acta
(2004)
357
3351
(doi: 10.1016/j.ica.2004.03.034)
Crystal nucleation of colloidal suspensions under shear
Physical review letters
(2004)
93
068303
The steady-state of heterogeneous catalysis, studied by first-principles statistical mechanics
(2004)
Liquid Water from First Principles: Investigation of Different Sampling Approaches
The Journal of Physical Chemistry B
(2004)
108
12990
(doi: 10.1021/jp047788i)
Synthesis and acid catalyzed hydrolysis of B-2,B-5 type conformationally constrained glucopyranosides: incorporation into a cellobiose analogue
Tetrahedron
(2004)
60
6813
(doi: 10.1016/j.tet.2004.06.009)
Radiocarbon (14C)-deduced biogenic and anthropogenic contributions to organic carbon (OC) of urban aerosols from Zurich, Switzerland
Atmospheric Environment
(2004)
38
4035
