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- Currently displaying 20041 - 20060 of 29283 publications
Multiresolution quantum chemistry in multiwavelet bases: time-dependent density functional theory with asymptotically corrected potentials in local density and generalized gradient approximations
Molecular Physics
(2005)
103
413
(doi: 10.1080/00268970412331319236)
A new, low-temperature polymorph of O′-SiAlON
Journal of the American Ceramic Society
(2005)
81
2188
Selective polymorph transformation via solvent -drop grinding
Chemical communications (Cambridge, England)
(2005)
880
(doi: 10.1039/b416980h)
Strong in Vivo Maturation Compensates for Structurally Restricted H3 Loops in Antibody Repertoires*
Journal of Biological Chemistry
(2005)
280
14114
(doi: 10.1074/jbc.m413011200)
Comment on "a centroid molecular dynamics study of liquid para hydrogen and ortho deuterium" [J. Chem. Phys. 121, 6412 (2004)]
The Journal of chemical physics
(2005)
122
057101
(doi: 10.1063/1.1839867)
Cover Picture: Self‐Assembly of the Octanuclear Cluster [Cu8(OH)10(NH2(CH2)2CH3)12]6+ and the One‐Dimensional N‐Propylcarbamate‐Linked Coordination Polymer {[Cu(O2CNH(CH2)2CH3)(NH2(CH2)2CH3)3](ClO4)}n (Chem. Eur. J. 3/2005)
Chemistry - A European Journal
(2005)
11
795
(doi: 10.1002/chem.200590008)
CBED study of grain misorientations in AlGaN epilayers
Ultramicroscopy
(2005)
103
23
Self‐Assembly of the Octanuclear Cluster [Cu8(OH)10(NH2(CH2)2CH3)12]6+ and the One‐Dimensional N‐Propylcarbamate‐Linked Coordination Polymer {[Cu(O2CNH(CH2)2CH3)(NH2(CH2)2CH3)3](ClO4)}n
Chemistry - A European Journal
(2005)
11
825
(doi: 10.1002/chem.200400555)
Influence of El Niño Southern Oscillation on stratosphere/troposphere exchange and the global tropospheric ozone budget
Geophysical Research Letters
(2005)
32
1
(doi: 10.1029/2004gl021353)
Simultaneous determination of protein structure and dynamics
Nature
(2005)
433
128
(doi: 10.1038/nature03199)
Preparation of pyridinyl/pyridazinyloxymethyl substituted Raf kinase inhibitors : WO 2005/002673 A1
(2005)
Prediction of Site-Specific Amino Acid Distributions and Limits of Divergent Evolutionary Changes in Protein Sequences
Molecular Biology and Evolution
(2005)
22
1156
(doi: 10.1093/molbev/msi116)
Real and reciprocal space structural correlations contributing to the first sharp diffraction peak in silica glass
Physical Review B
(2005)
71
014202
(doi: 10.1103/physrevb.71.014202)
Comparative analysis of protein-bound ligand conformations with respect to catalyst's conformational space subsampling algorithms
Journal of chemical information and modeling
(2005)
45
422
(doi: 10.1021/ci0497531)
Identification of 3-(acylamino)azepan-2-ones as stable broad-spectrum chemokine inhibitors resistant to metabolism in vivo.
Journal of Medicinal Chemistry
(2005)
48
867
(doi: 10.1021/jm049365a)
Asymmetric cyclopropane synthesis via phosphine oxide mediated cascade reactions.
Org Biomol Chem
(2005)
3
630
(doi: 10.1039/b413500h)
Experimental Data Checker: Better Information for Organic Chemists
ChemInform
(2005)
36
no
(doi: 10.1002/chin.200506241)
The Total Synthesis of the Annonaceous Acetogenin 10‐Hydroxyasimicin
Angew Chem Int Ed Engl
(2005)
44
580
(doi: 10.1002/anie.200462264)
Hydrogen bonding preference of equatorial versus axial hydroxyl groups in pyran and cyclohexane rings in organic crystals
CrystEngComm
(2005)
7
71
(doi: 10.1039/b417569g)
High-resolution absorption cross sections of formaldehyde at wavelengths from 313 to 320 nm
Physical chemistry chemical physics : PCCP
(2005)
7
79
(doi: 10.1039/b414183k)