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  • Currently displaying 16321 - 16340 of 31566 publications
Author(s)
Publication title
Journal Name
Publication year
Solvent Additive Control of Morphology and Crystallization in Semiconducting Polymer Blends
X Liu, S Huettner, Z Rong, M Sommer, RH Friend
Advanced materials (Deerfield Beach, Fla.)
(2011)
24
Influence of H-bond strength on chelate cooperativity
CA Hunter, MC Misuraca, SM Turega
Journal of the American Chemical Society
(2011)
133
Extracting elements of molecular structure from the all-particle wave function.
E Mátyus, J Hutter, U Müller-Herold, M Reiher
The Journal of chemical physics
(2011)
135
Polyglycerol‐Derived Amphiphiles for the Solubilization of Single‐Walled Carbon Nanotubes in Water: A Structure–Property Study
CS Popeney, A Setaro, R-C Mutihac, P Bluemmel, B Trappmann, J Vonneman, S Reich, R Haag
Chemphyschem
(2011)
13
peri-Dimethylamino substituent effects on proton transfer at carbon in α-naphthylacetate esters: a model for mandelate racemase.
RJ Delley, S Bandyopadhyay, MA Fox, C Schliehe, DRW Hodgson, F Hollfelder, AJ Kirby, AC O'Donoghue
Organic & Biomolecular Chemistry
(2011)
10
Which Compound to Select in Lead Optimization? Prospectively Validated Proteochemometric Models Guide Preclinical Development
GJP van Westen, JK Wegner, P Geluykens, L Kwanten, I Vereycken, A Peeters, AP Ijzerman, HWT van Vlijmen, A Bender
Plos One
(2011)
6
Continuous Preparation of Arylmagnesium Reagents in Flow with Inline IR Monitoring
T Brodmann, P Koos, A Metzger, P Knochel, SV Ley
Organic Process Research & Development
(2011)
16
Label-free fluorescence detection of the depurination activity of ribosome inactivating protein toxins
AA Tanpure, P Patheja, SG Srivatsan
Chemical communications (Cambridge, England)
(2011)
48
Gas-Phase Formation of Large Neutral Alkaline-Earth Metal Tryptophan Complexes
M Marksteiner, P Haslinger, H Ulbricht, M Sclafani, H Oberhofer, C Dellago, M Arndt
J Am Soc Mass Spectrom
(2011)
19
Monte Carlo simulations
D FRENKEL
Classical and Quantum Dynamics in Condensed Phase Simulations
(2011)
Activating Water: Important Effects of Non‐leaving Groups on the Hydrolysis of Phosphate Triesters
AJ Kirby, M Medeiros, PSM Oliveira, ES Orth, TAS Brandão, EH Wanderlind, A Amer, NH Williams, F Nome
Chemistry (Weinheim an der Bergstrasse, Germany)
(2011)
17
High-efficiency InGaN/GaN quantum well structures on large area silicon substrates
D Zhu, C McAleese, M Häberlen, MJ Kappers, N Hylton, P Dawson, G Radtke, M Couillard, GA Botton, S Sahonta, CJ Humphreys
physica status solidi (a)
(2011)
209
The influence of overconstraint on the spatial distribution of mobility in an amorphous network.
VK de Souza, P Harrowell
J Chem Phys
(2011)
135
Pure vibrational dephasing of triiodide in liquids and glasses
FS ZHANG, RM LYNDEN-BELL
Modern Physics Letters A
(2011)
18
Lattice Fokker-Planck equation
S SUCCI, S MELCHIONNA, J-P HANSEN
International Journal of Modern Physics C
(2011)
17
Fast Algorithms for Slow Processes in Lattice-Gas Cellular Automata
D FRENKEL
International Journal of Modern Physics C
(2011)
02
Theoretical studies of nickel atoms and nickel(II) ions coordinated with CO and BF ligands
SAC McDowell, AD Buckingham
Chemical Physics Letters
(2011)
516
Coarse Graining Escherichia coli Chemotaxis: From Multi-flagella Propulsion to Logarithmic Sensing
T Curk, F Matthäus, Y Brill-Karniely, J Dobnikar
Advances in Experimental Medicine and Biology
(2011)
736
From in silico target prediction to multi-target drug design: Current databases, methods and applications
A Koutsoukas, B Simms, J Kirchmair, PJ Bond, AV Whitmore, S Zimmer, MP Young, JL Jenkins, M Glick, RC Glen, A Bender
Journal of Proteomics
(2011)
74
Towards crystal structure prediction of complex organic compounds--a report on the fifth blind test.
DA Bardwell, CS Adjiman, YA Arnautova, E Bartashevich, SXM Boerrigter, DE Braun, AJ Cruz-Cabeza, GM Day, RG Della Valle, GR Desiraju, BP van Eijck, JC Facelli, MB Ferraro, D Grillo, M Habgood, DWM Hofmann, F Hofmann, KVJ Jose, PG Karamertzanis, AV Kazantsev, J Kendrick, LN Kuleshova, FJJ Leusen, AV Maleev, AJ Misquitta, S Mohamed, RJ Needs, MA Neumann, D Nikylov, AM Orendt, R Pal, CC Pantelides, CJ Pickard, LS Price, SL Price, HA Scheraga, J van de Streek, TS Thakur, S Tiwari, E Venuti, IK Zhitkov
Acta Crystallogr B
(2011)
67