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  • Currently displaying 18601 - 18620 of 29853 publications
Author(s)
Publication title
Journal Name
Publication year
Single molecule pulling with large time steps.
H Oberhofer, C Dellago, S Boresch
Physical Review E Statistical Nonlinear and Soft Matter Physics
(2007)
75
Protein structure determination from NMR chemical shifts.
A Cavalli, X Salvatella, CM Dobson, M Vendruscolo
Proc Natl Acad Sci U S A
(2007)
104
Designing an extracellular matrix protein with enhanced mechanical stability
SP Ng, KS Billings, T Ohashi, MD Allen, RB Best, LG Randles, HP Erickson, J Clarke
Proceedings of the National Academy of Sciences
(2007)
104
Evaluation of < S-2 > in density functional theory
AJ Cohen, DJ Tozer, NC Handy
The Journal of Chemical Physics
(2007)
126
OmpA: Gating and dynamics via molecular dynamics simulations
S Khalid, PJ Bond, T Carpenter, MSP Sansom
Biochimica et Biophysica Acta (BBA) - Biomembranes
(2007)
1778
Structural surface investigations of cerium-zirconium mixed oxide nanocrystals with enhanced reducibility
JC Hernandez, AB Hungria, JA Perez-Omil, S Trasobares, S Bernal, PA Midgley, A Alavi, JJ Calvino
The Journal of Physical Chemistry C
(2007)
111
Synthesis and catalytic properties in olefin epoxidation of dioxomolybdenurn(VI) complexes bearing a bidentate or tetradentate salen-type ligand
SM Bruno, SS Balula, AA Valente, FAA Paz, M Pillinger, C Sousa, J Klinowski, C Freire, P Ribeiro-Claro, IS Gonçalves
Molecular Catalysis
(2007)
270
New synthetic pathways into dithiazolyl radicals: Preparation and characterisation of 3 '-methyl-benzo-1,3,2-dithiazolyl, M'BDTA
A Alberola, RJ Collis, RJ Less, JM Rawson
Journal of Organometallic Chemistry
(2007)
692
Cyclophosphazenes tethered together via N-ring centres with ortho-, meta- and para-xylylene linkers
MA Benson, R Boomishankar, DS Wright, A Steiner
Journal of Organometallic Chemistry
(2007)
692
Comparison between Reflectance/Emittance Spectra of Iron-containing Minerals
D Borisoval, H Nikolov, M Danov, V Tsanev
Proceedings of the 3rd International Conference on Recent Advances in Space Technologies Rast 2007
(2007)
4
Structural control of dithiazolyl radicals:: Case studies on 3′- and 4′-cyano-benzo-1,3,2-dithiazolyl, NCC6H3S2N
A Alberola, J Burley, RJ Collis, RJ Less, JM Rawson
Journal of Organometallic Chemistry
(2007)
692
Analysis of Pharmacology Data and the Prediction of Adverse Drug Reactions and Off‐Target Effects from Chemical Structure
A Bender, J Scheiber, M Glick, JW Davies, K Azzaoui, J Hamon, L Urban, S Whitebread, JL Jenkins
Chemmedchem
(2007)
2
Pharmaceutical strategy and innovation: an academics perspective.
IR Baxendale, JJ Hayward, SV Ley, GK Tranmer
ChemMedChem
(2007)
2
Modeling promiscuity based on in vitro safety pharmacology profiling data
K Azzaoui, J Hamon, B Faller, S Whitebread, E Jacoby, A Bender, JL Jenkins, L Urban
ChemMedChem
(2007)
2
Pattern formation during the oxidation of CO on Pt{100}: a mesoscopic model.
RB Hoyle, AT Anghel, MRE Proctor, DA King
Physical review letters
(2007)
98
Free energy calculation of water addition coupled to reduction of aqueous RuO4-
Y Tateyama, J Blumberger, T Ohno, M Sprik
Journal of Chemical Physics
(2007)
126
(S)- and (R)-5-Pyrrolidin-2-yl-1H-tetrazoles: Enantiomeric organocatalysts of broad utility in organic synthesis
DA Longbottom, V Franckevičius, SV Ley
CHIMIA International Journal for Chemistry
(2007)
61
Comparative study of temperature dependent orientational relaxation in a model thermotropic liquid crystal and in a model supercooled liquid.
D Chakrabarti, B Bagchi
Journal of Chemical Physics
(2007)
126
Spectral emissivity measurement of rocks and rock-forming minerals
M Danov, V Tsanev, D Petkov
Proceedings of SPIE the International Society for Optical Engineering
(2007)
6604
The helix-turn-helix motif as an ultrafast independently folding domain: the pathway of folding of Engrailed homeodomain.
TL Religa, CM Johnson, DM Vu, SH Brewer, RB Dyer, AR Fersht
Proceedings of the National Academy of Sciences of the United States of America
(2007)
104