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  • Currently displaying 15501 - 15520 of 30922 publications
Author(s)
Publication title
Journal Name
Publication year
Quantifying reversibility in a phase-separating lattice gas: an analogy with self-assembly.
J Grant, RL Jack
Phys Rev E Stat Nonlin Soft Matter Phys
(2012)
85
Adsorption geometry determines catalytic selectivity in highly chemoselective hydrogenation of crotonaldehyde on Ag(111)
K Brandt, ME Chiu, DJ Watson, MS Tikhov, RM Lambert
Journal of Physical Chemistry C
(2012)
116
Ortho-trifluoromethylation of functionalized aromatic triazenes.
A Hafner, S Bräse
Angew Chem Int Ed Engl
(2012)
51
Blind testing of routine, fully automated determination of protein structures from nmr data
A Rosato, JM Aramini, C Arrowsmith, A Bagaria, D Baker, A Cavalli, JF Doreleijers, A Eletsky, A Giachetti, P Guerry, A Gutmanas, P Güntert, Y He, T Herrmann, YJ Huang, V Jaravine, HRA Jonker, MA Kennedy, OF Lange, G Liu, TE Malliavin, R Mani, B Mao, GT Montelione, M Nilges, P Rossi, G Van Der Schot, H Schwalbe, TA Szyperski, M Vendruscolo, R Vernon, WF Vranken, S De Vries, GW Vuister, B Wu, Y Yang, AMJJ Bonvin
Structure
(2012)
20
Full configuration interaction perspective on the homogeneous electron gas
JJ Shepherd, G Booth, A Grüneis, A Alavi
Physical Review B
(2012)
85
The interaction of iron pyrite with oxygen, nitrogen and nitrogen oxides: a first-principles study
M Sacchi, MCE Galbraith, SJ Jenkins
Phys Chem Chem Phys
(2012)
14
The molecular basis for selective inhibition of unconventional mRNA splicing by an IRE1-binding small molecule
BCS Cross, PJ Bond, PG Sadowski, BK Jha, J Zak, JM Goodman, RH Silverman, TA Neubert, IR Baxendale, D Ron, HP Harding
Proceedings of the National Academy of Sciences
(2012)
109
The sign problem and population dynamics in the full configuration interaction quantum Monte Carlo method
JS Spencer, NS Blunt, WMC Foulkes
The Journal of Chemical Physics
(2012)
136
A Second-Generation Total Synthesis of Spirastrellolide A Methyl Ester
I Paterson, P Maltas, SM Dalby, JH Lim, EA Anderson
Angew Chem Int Ed Engl
(2012)
51
A facile synthesis of dynamic supramolecular aggregates of cucurbit[n]uril (n=5-8) capped with gold nanoparticles in aqueous media
TC Lee, OA Scherman
Chemistry A European Journal
(2012)
18
Genetically encoded norbornene directs site-specific cellular protein labelling via a rapid bioorthogonal reaction.
K Lang, L Davis, J Torres-Kolbus, C Chou, A Deiters, JW Chin
Nature chemistry
(2012)
4
Small-molecule-induced DNA damage identifies alternative DNA structures in human genes.
R Rodriguez, KM Miller, JV Forment, CR Bradshaw, M Nikan, S Britton, T Oelschlaegel, B Xhemalce, S Balasubramanian, SP Jackson
Nature chemical biology
(2012)
8
Identification of HIV-1 reverse transcriptase dual inhibitors by a combined shape-, 2D-fingerprint- and pharmacophore-based virtual screening approach.
S Distinto, F Esposito, J Kirchmair, MC Cardia, M Gaspari, E Maccioni, S Alcaro, P Markt, G Wolber, L Zinzula, E Tramontano
European journal of medicinal chemistry
(2012)
50
Facile access to versatile fluorescent carbon dots toward light-emitting diodes.
X Guo, C-F Wang, Z-Y Yu, L Chen, S Chen
Chem Commun (Camb)
(2012)
48
Temperature and pressure dependence of the rate coefficient for the reaction between ClO and CH3O2 in the gas-phase.
KE Leather, A Bacak, R Wamsley, AT Archibald, A Husk, DE Shallcross, CJ Percival
Physical chemistry chemical physics : PCCP
(2012)
14
Infection-Responsive Expansion of the Hematopoietic Stem and Progenitor Cell Compartment in Zebrafish Is Dependent upon Inducible Nitric Oxide
CJ Hall, MV Flores, SH Oehlers, LE Sanderson, EY Lam, KE Crosier, PS Crosier
Cell stem cell
(2012)
10
Structurally determined directionality identifies the boundary between mobile and immobile domains in a disordered material
VK de Souza, P Harrowell
The Journal of Chemical Physics
(2012)
136
Genetically encoded tetrazine amino acid directs rapid site-specific in vivo bioorthogonal ligation with trans-cyclooctenes.
JL Seitchik, JC Peeler, MT Taylor, ML Blackman, TW Rhoads, RB Cooley, C Refakis, JM Fox, RA Mehl
Journal of the American Chemical Society
(2012)
134
Diffraction from physisorbed layers
T Arnold, SM Clarke
Current Opinion in Colloid and Interface Science
(2012)
17
Atomistic molecular simulations of protein folding
RB Best
Current Opinion in Structural Biology
(2012)
22