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  • Currently displaying 13561 - 13580 of 29910 publications
Author(s)
Publication title
Journal Name
Publication year
Nuclear quantum effects on the stability of cationic neon clusters
F Calvo, FY Naumkin, DJ Wales
Chemical Physics Letters
(2012)
551
Generation of 2D organic microsheets from protonated melamine derivatives: Suppression of the self assembly of a particular dimension by introduction of alkyl chains
J Xu, G Wu, Z Wang, X Zhang
Chemical Science
(2012)
3
Molecular characterization of the interaction of crotamine-derived nucleolar targeting peptides with lipid membranes
M Rodrigues, A Santos, BG de la Torre, G Rádis-Baptista, D Andreu, NC Santos
Biochim Biophys Acta
(2012)
1818
Triggered insulin release studies of triply responsive supramolecular micelles
XJ Loh, M-H Tsai, J del Barrio, EA Appel, T-C Lee, OA Scherman
Polymer Chemistry
(2012)
3
Structural transition in rare earth doped zirconium oxide: A positron annihilation study
K Chakraborty, A Bisoi, BN Ganguly, V Grover, FN Sayed, AK Tyagi
Materials Research Bulletin
(2012)
47
Spiers memorial lecture: Effect of interaction specificity on the phase behaviour of patchy particles
N Dorsaz, L Filion, F Smallenburg, D Frenkel
Faraday Discussions
(2012)
159
Reconstructed Ribbon Edges in Thermally Reduced Graphene Nanoribbons
M Acik, J Carretero-González, E Castillo-Martínez, DM Rogers, R Guzman, RH Baughman, YJ Chabal
The Journal of Physical Chemistry C
(2012)
116
PaDEL-DDPredictor: Open-source software for PD-PK-T prediction
Y He, CY Liew, N Sharma, SK Woo, YT Chau, CW Yap
Journal of computational chemistry
(2012)
34
Cheminformatics
JK Wegner, A Sterling, R Guha, A Bender, J-L Faulon, J Hastings, N O'Boyle, J Overington, H Van Vlijmen, E Willighagen
Communications of the ACM
(2012)
55
Felodipine-diazabicyclo[2.2.2]octane-water (1/1/1)
KA Solanko, AO Surov, GL Perlovich, A Bauer-Brandl, AD Bond
Acta Crystallographica Section C Crystal Structure Communications
(2012)
68
An explicitly correlated approach to basis set incompleteness in full configuration interaction quantum Monte Carlo
GH Booth, D Cleland, A Alavi, DP Tew
The Journal of chemical physics
(2012)
137
The influence of water and metal ions on the transport properties of trihexyl(tetradecyl)phosphonium chloride
PM Bayley, J Novak, T Khoo, MM Britton, PC Howlett, DR Macfarlane, M Forsyth
Australian Journal of Chemistry
(2012)
65
Direct surface analysis of time-resolved aerosol impactor samples with ultrahigh-resolution mass spectrometry
SJ Fuller, Y Zhao, SS Cliff, AS Wexler, M Kalberer
Anal Chem
(2012)
84
Modelling future changes to the stratospheric source gas injection of biogenic bromocarbons
R Hossaini, MP Chipperfield, S Dhomse, C Ordóñez, A Saiz‐Lopez, NL Abraham, A Archibald, P Braesicke, P Telford, N Warwick, X Yang, J Pyle
Geophysical Research Letters
(2012)
39
Highly enantio- and diastereoselective generation of two quaternary centers in spirocyclopropanation of oxindole derivatives.
A Noole, NS Sucman, MA Kabeshov, T Kanger, FZ Macaev, AV Malkov
Chemistry (Weinheim an der Bergstrasse, Germany)
(2012)
18
Chemical physics of protein folding.
PG Wolynes, WA Eaton, AR Fersht
Proceedings of the National Academy of Sciences
(2012)
109
Tropical convective transport and the Walker circulation
JS Hosking, MR Russo, P Braesicke, JA Pyle
Atmospheric Chemistry and Physics
(2012)
12
On the energetic dependence of charge separation in low-band-gap polymer/fullerene blends
SD Dimitrov, AA Bakulin, CB Nielsen, BC Schroeder, J Du, H Bronstein, I McCulloch, RH Friend, JR Durrant
J Am Chem Soc
(2012)
134
Alkyltransferase-like protein (Atl1) distinguishes alkylated guanines for DNA repair using cation-pi interactions
OJ Wilkinson, V Latypov, JL Tubbs, CL Millington, R Morita, H Blackburn, A Marriott, G McGown, M Thorncroft, AJ Watson, BA Connolly, JA Grasby, R Masui, CA Hunter, JA Tainer, GP Margison, DM Williams
Proceedings of the National Academy of Sciences
(2012)
109
Kinetic and computational evidence for an intermediate in the hydrolysis of sulfonate esters.
AC Babtie, MF Lima, AJ Kirby, F Hollfelder
Organic & biomolecular chemistry
(2012)
10