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  • Currently displaying 18441 - 18460 of 29882 publications
Author(s)
Publication title
Journal Name
Publication year
Small energy differences in molecular crystals: A first principles study of tautomerism and dynamics in benzoic acid derivatives
DS Middlemiss, M Facchini, CA Morrison, CC Wilson
Crystengcomm
(2007)
9
The temperature-dependence of elementary reaction rates: beyond Arrhenius.
IWM Smith
Chemical Society Reviews
(2007)
37
Synthesis of an advanced C10-C32 spiroacetal fragment and assignment of the absolute configuration of spirangien A
I Paterson, AD Findlay, EA Anderson
Angewandte Chemie (International ed. in English)
(2007)
46
What is a co-crystal?
AD Bond
Crystengcomm
(2007)
9
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)
A Michaelides
Surface Science
(2007)
601
Redox free energies and one-electron energy levels in density functional theory based ab initio molecular dynamics
J VandeVondele, R Ayala, M Sulpizi, M Sprik
Journal of Electroanalytical Chemistry
(2007)
607
Bis(triethylammonium) 4,4′-diamino-trans-stilbene-2,2′-disulfonate
S Dufresne, M Gaultois, WG Skene
Acta Crystallographica Section E: Crystallographic Communications
(2007)
63
Using terahertz time-domain spectroscopy to identify pharmaceutical cocrystals
EPJ Parrott, KL Nguyen, T Friscic, JA Zeitler, M Pepper, W Jones, LF Gladden
2007 Joint 32nd International Conference on Infrared and Millimeter Waves and the 15th International Conference on Terahertz Electronics
(2007)
Vibrational frequencies of CO on Pt(1 1 1) in electric field: A periodic DFT study
AY Lozovoi, A Alavi
Journal of Electroanalytical Chemistry
(2007)
607
Chemogenomic data analysis: prediction of small-molecule targets and the advent of biological fingerprint.
A Bender, DW Young, JL Jenkins, M Serrano, D Mikhailov, PA Clemons, JW Davies
Combinatorial Chemistry & High Throughput Screening
(2007)
10
When adding an unreactive metal enhances catalytic activity:: NOx decomposition over silver-rhodium bimetallic surfaces
OR Inderwildi, SJ Jenkins, DA King
Surface Science
(2007)
601
The distribution of residues in a polypeptide sequence is a determinant of aggregation optimized by evolution
E Monsellier, M Ramazzotti, PP de Laureto, G-G Tartaglia, N Taddei, A Fontana, M Vendruscolo, F Chiti
Biophysical Journal
(2007)
93
The role of the turn in beta-hairpin formation during WW domain folding.
T Sharpe, AL Jonsson, TJ Rutherford, V Daggett, AR Fersht
Protein science : a publication of the Protein Society
(2007)
16
Electrochemical characteristics of polyelectrolyte brushes with electroactive counterions
E-Y Choi, O Azzaroni, N Cheng, F Zhou, T Kelby, WTS Huck
Langmuir
(2007)
23
Reversible self-assembly of patchy particles into monodisperse icosahedral clusters
AW Wilber, JPK Doye, AA Louis, EG Noya, MA Miller, P Wong
J Chem Phys
(2007)
127
Synthesis, characterisation and luminescent properties of lanthanide-organic polymers with picolinic and glutaric acids
PI Girginova, FAA Paz, PCR Soares‐Santos, RAS Ferreira, LD Carlos, VS Amaral, J Klinowski, HIS Nogueira, T Trindade
European Journal of Inorganic Chemistry
(2007)
2007
Coenzyme biosynthesis: Enzyme mechanism, structure and inhibition
DE Scott, A Ciulli, C Abell
Natural Product Reports
(2007)
24
A self-assembly approach to chemical micropatterning of poly(dimethylsiloxane).
ML van Poll, F Zhou, M Ramstedt, L Hu, WTS Huck
Angewandte Chemie (International ed. in English)
(2007)
46
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 beta-amyloid plaques.
L Cai, J Cuevas, S Temme, MM Herman, C Dagostin, DA Widdowson, RB Innis, VW Pike
J Med Chem
(2007)
50
A Large Descriptor Set and a Probabilistic Kernel-Based Classifier Significantly Improve Druglikeness Classification
Q Li, A Bender, J Pei, L Lai
Journal of Chemical Information and Modeling
(2007)
47