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  • Currently displaying 13541 - 13560 of 29882 publications
Author(s)
Publication title
Journal Name
Publication year
PaDEL-DDPredictor: Open-source software for PD-PK-T prediction
Y He, CY Liew, N Sharma, SK Woo, YT Chau, CW Yap
J Comput Chem
(2012)
34
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
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
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: Structural Chemistry
(2012)
68
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
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
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 of the United States of America
(2012)
109
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
Kinetic and computational evidence for an intermediate in the hydrolysis of sulfonate esters.
AC Babtie, MF Lima, AJ Kirby, F Hollfelder
Org Biomol Chem
(2012)
10
Photonic structures in plants
S Vignolini, B Glover, U Steiner
(2012)
Dissecting fragment-based lead discovery at the von Hippel-Lindau protein:hypoxia inducible factor 1α protein-protein interface.
I Van Molle, A Thomann, DL Buckley, EC So, S Lang, CM Crews, A Ciulli
Chem Biol
(2012)
19
Preparation of bicyclic heterocycles as anticancer agents : WO 2012/143726 A1
AJ Woolford, S Howard, IM Buck, G Chessari, CN Johnson, E Tamanini, JEH Day, E Chiarparin, TD Heightman, M Frederickson, CM Griffiths-Jones
(2012)
Protein folding: adding a nucleus to guide helix docking reduces landscape roughness.
BG Wensley, LG Kwa, SL Shammas, JM Rogers, J Clarke
Journal of molecular biology
(2012)
423
Sum Frequency Generation Spectrum of a Self-Assembled Monolayer Containing Two Different Methyl Group Orientations
PJN Kett, MTL Casford, PB Davies
Journal of Physical Chemistry Letters
(2012)
3
Stability of p53 homologs.
T Brandt, JL Kaar, AR Fersht, DB Veprintsev
Plos One
(2012)
7
Tuning Fluorescent Molecules by Inclusion in a Metal–Organic Framework: An Experimental and Computational Study
D Yan, GO Lloyd, A Delori, W Jones, X Duan
ChemPlusChem
(2012)
77
Total Synthesis of Alotaketal A
M Xuan, I Paterson, SM Dalby
Org Lett
(2012)
14