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  • Currently displaying 18201 - 18220 of 30945 publications
Author(s)
Publication title
Journal Name
Publication year
Bimolecular reaction rates from ring polymer molecular dynamics.
R Collepardo-Guevara, YV Suleimanov, DE Manolopoulos
The Journal of chemical physics
(2009)
130
Hydrometalation of fluoroallenes.
MF Kühnel, D Lentz
Dalton Trans
(2009)
Reconstructing the equilibrium Boltzmann distribution from well-tempered metadynamics.
M Bonomi, A Barducci, M Parrinello
J Comput Chem
(2009)
30
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
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
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
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
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
Scaling behavior of the disordered contact process
SV Fallert, SN Taraskin
Physical review. E, Statistical, nonlinear, and soft matter physics
(2009)
79
[1,2-Bis(diphenylphosphino)-1,2-dicarba-closo-dodecaborane-kappa P-2,P '][7,8-bis(diphenylphosphino)-7,8-dicarba-nido-undecaborato-kappa P-2,P ']gold(I)-dichloromethane-water (2/1/1)
JA Ioppolo, JK Clegg, LM Rendina
Acta Crystallogr Sect E Struct Rep Online
(2009)
65
Efficient Extraction of Free Energy Profiles From Nonequilibrium Experiments
H Oberhofer, C Dellago
J Comput Chem
(2009)
30
A New Polymorph of N,N′-Dimethylurea Characterized by X-ray Diffraction and First-Principles Lattice Dynamics Calculations
DMS Martins, CK Spanswick, DS Middlemiss, N Abbas, CR Pulham, CA Morrison
The Journal of Physical Chemistry A
(2009)
113
Charge-transfer in Symmetry-Adapted Perturbation Theory
AJ Stone, AJ Misquitta
Chemical Physics Letters
(2009)
473
Coupling microdroplet microreactors with mass spectrometry: reading the contents of single droplets online.
LM Fidalgo, G Whyte, BT Ruotolo, JLP Benesch, F Stengel, C Abell, CV Robinson, WTS Huck
Angew Chem Int Ed Engl
(2009)
48
Influence of the Benzoquinone Sorption on the Structure and Electrochemical Performance of the MIL-53(Fe) Hybrid Porous Material in a Lithium-Ion Battery
G de Combarieu, M Morcrette, F Millange, N Guillou, J Cabana, CP Grey, I Margiolaki, G Férey, J-M Tarascon
Chemistry of Materials
(2009)
21
Chemical modification of proteins at cysteine: opportunities in chemistry and biology.
JM Chalker, GJL Bernardes, YA Lin, BG Davis
Chemistry, an Asian journal
(2009)
4
The CO2 inhibition of terrestrial isoprene emission significantly affects future ozone projections
PJ Young, A Arneth, G Schurgers, G Zeng, JA Pyle
Atmospheric Chemistry and Physics
(2009)
9
Controlled catch and release of small molecules with cucurbit[6]uril via a kinetic trap
L Liu, N Nouvel, OA Scherman
Chem Commun (Camb)
(2009)
Anchoring sites for initial Au nucleation on ceo2{111}: o vacancy versus ce vacancy
C Zhang, A Michaelides, DA King, SJ Jenkins
Journal of Physical Chemistry C
(2009)
113