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  • Currently displaying 17661 - 17680 of 30400 publications
Author(s)
Publication title
Journal Name
Publication year
Insight from first principles into the nature of the bonding between water molecules and 4d metal surfaces
J Carrasco, A Michaelides, M Scheffler
Journal of Chemical Physics
(2009)
130
Physical principles of protein behavior in the cell
M Porto, HE Roman, M Vendruscolo
Journal of Proteome Research
(2009)
8
Folding of small proteins by Monte Carlo simulations with chemical shift restraints without the use of molecular fragment replacement or structural homology.
P Robustelli, A Cavalli, CM Dobson, M Vendruscolo, X Salvatella
Journal of Physical Chemistry B
(2009)
113
Polymeric di- and discrete trinuclear silver(I) assemblies incorporating γ-carbon bonded, neutral acetylacetone-imine motifs assembled from racemic and diastereopure N,N′-bis(acetylacetone)cyclohexanediimine units
B-X Zhu, Q-L Zhang, Y-Q Zhang, Z Tao, JK Clegg, JR Reimers, LF Lindoy, G Wei
Dalton transactions (Cambridge, England : 2003)
(2009)
Highly Potent, Orally Available Anti-inflammatory Broad-Spectrum Chemokine Inhibitors
DJ Fox, J Reckless, H Lingard, S Warren, DJ Grainger
J Med Chem
(2009)
52
Thiamin diphosphate in biological chemistry: analogues of thiamin diphosphate in studies of enzymes and riboswitches
K Agyei-Owusu, FJ Leeper
The FEBS Journal
(2009)
276
Is synthesis the main hurdle for the generation of diversity in compound libraries for screening?
WR Galloway, DR Spring
Expert Opinion on Drug Discovery
(2009)
4
Synthesis of simplified analogues of eleutherobin via a Claisen rearrangement/RCM strategy
SYF Mak, GCH Chiang, JEP Davidson, JE Davies, A Ayscough, G Pain, JW Burton, AB Holmes
Tetrahedron Asymmetry
(2009)
20
Reconstructing the Equilibrium Boltzmann Distribution from Well-Tempered Metadynamics
M Bonomi, A Barducci, M Parrinello
J Comput Chem
(2009)
30
Hydrometalation of fluoroallenes
MF Kühnel, D Lentz
Dalton transactions (Cambridge, England : 2003)
(2009)
Bimolecular reaction rates from ring polymer molecular dynamics.
R Collepardo-Guevara, YV Suleimanov, DE Manolopoulos
The Journal of Chemical Physics
(2009)
130
Oxalate- and Squarate-Biimidazole Supramolecular Synthons: Hydrogen-Bonded Networks Based on [Co(H2biimidazole)3]3+
C Borel, K Larsson, M Håkansson, BE Olsson, AD Bond, L Öhrström
Crystal Growth & Design
(2009)
9
The short range anion-H interaction is the driving force for crystal formation of ions in water.
J Alejandre, GA Chapela, F Bresme, J-P Hansen
J Chem Phys
(2009)
130
PRIMA-1 Reactivates Mutant p53 by Covalent Binding to the Core Domain
JMR Lambert, P Gorzov, DB Veprintsev, M Söderqvist, D Segerbäck, J Bergman, AR Fersht, P Hainaut, KG Wiman, VJN Bykov
Cancer cell
(2009)
15
CHHC and 1H–1H magnetization exchange: Analysis by experimental solid-state NMR and 11-spin density-matrix simulations
M Aluas, C Tripon, JM Griffin, X Filip, V Ladizhansky, RG Griffin, SP Brown, C Filip
J Magn Reson
(2009)
199
Self-assembly of semiconductor organogelator nanowires for photoinduced charge separation.
A Wicklein, S Ghosh, M Sommer, F Würthner, M Thelakkat
ACS nano
(2009)
3
Efficient Extraction of Free Energy Profiles From Nonequilibrium Experiments
H Oberhofer, C Dellago
J Comput Chem
(2009)
30
The role of surface vanadia species in butane dehydrogenation over VOx/Al2O3
J McGregor, Z Huang, G Shiko, LF Gladden, RS Stein, MJ Duer, Z Wu, PC Stair, S Rugmini, SD Jackson
Catalysis Today
(2009)
142
[1,2-Bis(diphenyl-phosphino)-1,2-dicarba-closo-dodeca-borane-κP,P'][7,8-bis-(di-phenyl-phosphino)-7,8-dicarba-nido-undeca-borato-κP,P']gold(I)-dichloro-methane-water (2/1/1).
JA Ioppolo, JK Clegg, LM Rendina
Acta Crystallographica Section E: Crystallographic Communications
(2009)
65
Scaling behavior of the disordered contact process.
SV Fallert, SN Taraskin
Physical Review E Statistical Nonlinear and Soft Matter Physics
(2009)
79