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- Currently displaying 18481 - 18500 of 29917 publications
The temperature-dependence of elementary reaction rates: beyond Arrhenius.
Chemical Society reviews
(2007)
37
812
(doi: 10.1039/b704257b)
Small energy differences in molecular crystals: A first principles study of tautomerism and dynamics in benzoic acid derivatives
Crystengcomm
(2007)
9
777
(doi: 10.1039/b703181e)
Towards proton transfer in hydrogen bonded molecular complexes: joint experimental and theoretical modelling and an energy scale for polymorphism
Crystengcomm
(2007)
9
743
(doi: 10.1039/b709136m)
The unhappy marriage of transition and noble metal atoms: A new way to enhance catalytic activity? (A perspective on: "When adding an unreactive metal enhances catalytic activity: NOx decomposition over silver-rhodium bimetallic surfaces" by O.R. Inderwildi, S.J. Jenkins, D.A. King)
Surface Science
(2007)
601
3529
(doi: 10.1016/j.susc.2007.06.065)
Redox free energies and one-electron energy levels in density functional theory based ab initio molecular dynamics
Journal of Electroanalytical Chemistry
(2007)
607
113
Vibrational frequencies of CO on Pt(111) in electric field: A periodic DFT study
Journal of Electroanalytical Chemistry
(2007)
607
140
Using terahertz time-domain spectroscopy to identify pharmaceutical cocrystals
2007 Joint 32nd International Conference on Infrared and Millimeter Waves and the 15th International Conference on Terahertz Electronics
(2007)
660
(doi: 10.1109/icimw.2007.4516670)
Bis(triethylammonium) 4,4′-diamino-trans-stilbene-2,2′- disulfonate
Acta Crystallographica Section E: Crystallographic Communications
(2007)
63
o3926
(doi: 10.1107/S1600536807041360)
When adding an unreactive metal enhances catalytic activity: NOx decomposition over silver–rhodium bimetallic surfaces
Surface Science
(2007)
601
l103
(doi: 10.1016/j.susc.2007.06.031)
Chemogenomic data analysis: Prediction of small-molecule targets and the advent of biological fingerprints
Comb Chem High Throughput Screen
(2007)
10
719
(doi: 10.2174/138620707782507313)
The role of the turn in β‐hairpin formation during WW domain folding
Protein science : a publication of the Protein Society
(2007)
16
2233
(doi: 10.1110/ps.073004907)
Electrochemical characteristics of polyelectrolyte brushes with electroactive counterions
Langmuir : the ACS journal of surfaces and colloids
(2007)
23
10389
(doi: 10.1021/la7015116)
The distribution of residues in a polypeptide sequence is a determinant of aggregation optimized by evolution.
Biophysical journal
(2007)
93
4382
(doi: 10.1529/biophysj.107.111336)
Reversible self-assembly of patchy particles into monodisperse icosahedral clusters
J Chem Phys
(2007)
127
085106
(doi: 10.1063/1.2759922)
Synthesis, characterisation and luminescent properties of lanthanide-organic polymers with picolinic and glutaric acids
European Journal of Inorganic Chemistry
(2007)
2007
4238
(doi: 10.1002/ejic.200601213)
A Self‐Assembly Approach to Chemical Micropatterning of Poly(dimethylsiloxane)
Angewandte Chemie International Edition
(2007)
46
6634
(doi: 10.1002/anie.200702286)
Coenzyme biosynthesis: enzyme mechanism, structure and inhibition.
Natural product reports
(2007)
24
1009
(doi: 10.1039/b703108b)
Synthesis and Structure−Affinity Relationships of New 4-(6-Iodo-H-imidazo[1,2-a]pyridin-2-yl)-N-dimethylbenzeneamine Derivatives as Ligands for Human β-Amyloid Plaques
J Med Chem
(2007)
50
4746
(doi: 10.1021/jm0702231)
A Large Descriptor Set and a Probabilistic Kernel-Based Classifier Significantly Improve Druglikeness Classification
Journal of chemical information and modeling
(2007)
47
1776
(doi: 10.1021/ci700107y)
