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  • Currently displaying 19981 - 20000 of 29681 publications
Author(s)
Publication title
Journal Name
Publication year
Virtual‐Move Parallel Tempering
I Coluzza, D Frenkel
Chemphyschem : a European journal of chemical physics and physical chemistry
(2005)
6
From concentration profiles to polymer osmotic equations of state.
CI Addison, J-P Hansen, AA Louis
Chemphyschem
(2005)
6
A tribute to Michele Parrinello: From physics via chemistry to biology
W Andreoni, D Marx, M Sprik
Chemphyschem
(2005)
6
Lattice Monte Carlo simulations of the gyroid phase in monodisperse and bidisperse block copolymer systems
FJ Martínez-Veracoechea, FA Escobedo
Macromolecules
(2005)
38
Structure and dynamics of a confined ionic liquid. Topics of relevance to dye-sensitized solar cells.
C Pinilla, MG Del Pópolo, RM Lynden-Bell, J Kohanoff
The journal of physical chemistry. B
(2005)
109
Evaluation of different techniques for particle size distribution measurements on laser-generated aerosols
H-R Kuhn, J Koch, R Hergenröder, K Niemax, M Kalberer, D Günther
Journal of Analytical Atomic Spectrometry
(2005)
20
Characterisation of Disulfide‐Bond Dynamics in Non‐Native States of Lysozyme and Its Disulfide Deletion Mutants by NMR
ES Collins, J Wirmer, K Hirai, H Tachibana, S-I Segawa, CM Dobson, H Schwalbe
Chembiochem : a European journal of chemical biology
(2005)
6
Inverse Coordination of an Ionic Lattice by a Metal Host
MJ Duer, F García, RA Kowenicki, V Naseri, M McPartlin, ML Stead, RS Stein, DS Wright
Angew Chem Int Ed Engl
(2005)
44
High-resolution X-ray diffraction, DIFFaX, NMR and first principles study of disorder in the Li 2MnO 3-Li[Ni 1/2Mn 1/2]O 2 solid solution
J Bréger, M Jiang, N Dupré, YS Meng, Y Shao-Horn, G Ceder, CP Grey
Journal of Solid State Chemistry
(2005)
178
Discussion of measures of enrichment in virtual screening: Comparing the information content of descriptors with increasing levels of sophistication
A Bender, RC Glen
JOURNAL OF CHEMICAL INFORMATION AND MODELING
(2005)
45
Inverse Coordination of an Ionic Lattice by a Metal Host
MJ Duer, F García, RA Kowenicki, V Naseri, M McPartlin, ML Stead, RS Stein, DS Wright
Angewandte Chemie
(2005)
117
Ex situ NMR and neutron diffraction study of structure and lithium motion in Li7MnN4
J Cabana, N Dupré, G Rousse, CP Grey, MR Palacín
Solid State Ionics
(2005)
176
Catalyst-induced changes in a substituted aromatic: A combined approach via experiment and theory
YP Tan, S Khatua, SJ Jenkins, J-Q Yu, JB Spencer, DA King
Surface Science
(2005)
589
Stretching the Frontiers: Exploring the Relationships Between Entrepreneurship and Ethics
O Fisscher, D Frenkel, Y Lurie, A Nijhof
Journal of Business Ethics
(2005)
60
Targeting Nucleic Acid Secondary Structures with Polyamides Using an Optimized Dynamic Combinatorial Approach
S Ladame, AM Whitney, S Balasubramanian
Angewandte Chemie International Edition
(2005)
44
Electrochemical promotion by potassium of Rh-catalysed Fischer-Tropsch synthesis at high pressure
AJ Urquhart, FJ Williams, RM Lambert
Catalysis Letters
(2005)
103
Intramolecular general acid catalysis of sulfate transfer - Nucleophilic attack by oxyanions on the SO3- group
AJ Kirby, JC Gesser, F Hollfelder, JP Priebe, F Nome
Canadian Journal of Chemistry
(2005)
83
Osteogenic transcription factor Runx2 is required for maternal induction of ventral fate in zebrafish: A case for conserved mechanisms in bone formation and dorsoventral patterning
MV Flores, EYN Lam, PS Crosier, KE Crosier
MECHANISMS OF DEVELOPMENT
(2005)
122
Potential non cell-autonomous function for zebrafish Runx3 in T cell differentiation
EYN Lam, MV Flores, CJ Hall, PS Crosier, PE Crosier
MECHANISMS OF DEVELOPMENT
(2005)
122
A discrete metallocyclic complex that retains its solvent-templated channel structure on guest removal to yield a porous, gas sorbing material.
L Dobrzańska, GO Lloyd, HG Raubenheimer, LJ Barbour
Journal of the American Chemical Society
(2005)
127