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  • Currently displaying 14661 - 14680 of 29673 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
(2011)
24
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
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
Org Biomol Chem
(2011)
10
Compaction and binding properties of the intrinsically disordered C-terminal domain of Henipavirus nucleoprotein as unveiled by deletion studies
D Blocquel, J Habchi, A Gruet, S Blangy, S Longhi
Molecular BioSystems
(2011)
8
Influence of H-bond strength on chelate cooperativity
CA Hunter, MC Misuraca, SM Turega
Journal of the American Chemical Society
(2011)
133
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
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
Journal of the American Society for Mass Spectrometry
(2011)
19
Label-free fluorescence detection of the depurination activity of ribosome inactivating protein toxins
AA Tanpure, P Patheja, SG Srivatsan
Chem Commun (Camb)
(2011)
48
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
The influence of overconstraint on the spatial distribution of mobility in an amorphous network.
VK de Souza, P Harrowell
Journal of Chemical Physics
(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
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 Applications and Materials Science
(2011)
209
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
Fast Algorithms for Slow Processes in Lattice-Gas Cellular Automata
B HUMPERT, A DE KORVIN
International Journal of Modern Physics C
(2011)
2
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
Theoretical studies of nickel atoms and nickel(II) ions coordinated with CO and BF ligands
SAC McDowell, AD Buckingham
Chemical Physics Letters
(2011)
516
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 Crystallographica Section B: Structural Science, Crystal Engineering and Materials
(2011)
67
Reentrant transition in the shear viscosity of dilute rigid-rod dispersions.
H Kobayashi, R Yamamoto
Physical review. E, Statistical, nonlinear, and soft matter physics
(2011)
84