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  • Currently displaying 21081 - 21100 of 29280 publications
Author(s)
Publication title
Journal Name
Publication year
Continuous freezing in three dimensions - art. no. 195701
RP Sear, D Frenkel
Physical review letters
(2003)
90
Phase behavior of a lattice protein model
N Combe, D Frenkel
The Journal of Chemical Physics
(2003)
118
Theoretical study of finite-temperature spectroscopy in van der Waals clusters. II. Time-dependent absorption spectra
F Calvo, F Spiegelman, DJ Wales
Journal of Chemical Physics
(2003)
118
Dynamic covalent chemistry on self-templating peptides: Formation of a disulfide-linked β-hairpin mimic
Y Krishnan-Ghosh, S Balasubramanian
Angew Chem Int Ed Engl
(2003)
42
Radiative forcing in the 21st century due to ozone changes in the troposphere and the lower stratosphere
M Gauss, G Myhre, G Pitari, MJ Prather, ISA Isaksen, TK Berntsen, GP Brasseur, FJ Dentener, RG Derwent, DA Hauglustaine, LW Horowitz, DJ Jacob, M Johnson, KS Law, LJ Mickley, J Müller, P Plantevin, JA Pyle, HL Rogers, DS Stevenson, JK Sundet, M van Weele, O Wild
Journal of Geophysical Research Atmospheres
(2003)
108
Atomistic molecular dynamics simulations of chemical force microscopy
DL Patrick, JF Flanagan, P Kohl, RM Lynden-Bell
Journal of the American Chemical Society
(2003)
125
Synthesis and structure of the novel "paddle-wheel" complex [{(η5-Cp)2Pb(μ:η5-Cp)K}̇2THF]
RA Layfield, M McPartlin, DS Wright
Organometallics
(2003)
22
Solvent-induced symmetry breaking
FS Zhang, RM Lynden-Bell
Physical Review Letters
(2003)
90
Understanding the NMR shifts in paramagnetic transition metal oxides using density functional theory calculations
D Carlier, M Ménétrier, CP Grey, C Delmas, G Ceder
Physical Review B Condensed Matter and Materials Physics
(2003)
67
Protein folding and misfolding: a paradigm of self–assembly and regulation in complex biological systems
M Vendruscolo, J Zurdo, CE MacPhee, CM Dobson
Philosophical Transactions of the Royal Society of London. Series A: Mathematical, Physical and Engineering Sciences
(2003)
361
In situ ammonia generation as a strategy for catalytic NOx reduction under oxygen rich conditions
N Macleod, RM Lambert
Chem Commun (Camb)
(2003)
3
Toward the total synthesis of phorboxazole A: synthesis of an advanced C4–C32 subunit using the Jacobsen hetero Diels–Alder reaction
I Paterson, CA Luckhurst
Tetrahedron Letters
(2003)
44
Electronic excitation and transient defects in AS2S3 glass
T Uchino, SR Elliott
Physical Review B
(2003)
67
Understanding the NMR shifts in paramagnetic transition metal oxides using density functional theory calculations
D Carlier, M Ménétrier, CP Grey, C Delmas, G Ceder
Physical Review B Condensed Matter and Materials Physics
(2003)
67
Surface-sensitive molecular information on polymers from UV-resonance Raman spectroscopy
JH Wang, D Klenerman, A Van Der Pol, RJ Meier
Applied Spectroscopy
(2003)
57
Ligand-protein docking: cancer research at the interface between biology and chemistry.
RC Glen, SC Allen
Current Medicinal Chemistry
(2003)
10
Mechanistic Study and Catalyst Design for PhSSPh Addition Reaction to Alkyne Triple Bond
VP Ananikov, MA Kabeshov, IP Beletskaya
Doklady Chemistry
(2003)
390
Frequency-domain Hadamard spectroscopy
E Kupce, R Freeman
Journal of magnetic resonance (San Diego, Calif. : 1997)
(2003)
162
Complexation-induced chemical shifts--ab initio parameterization of transferable bond anisotropies.
MJ Packer, C Zonta, CA Hunter
Journal of Magnetic Resonance
(2003)
162
NMR study of n-dodecane adsorbed on graphite
MD Alba, MA Castro, SM Clarke, AC Perdigón
Solid state nuclear magnetic resonance
(2003)
23