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  • Currently displaying 21221 - 21240 of 29292 publications
Author(s)
Publication title
Journal Name
Publication year
Free energy landscapes of model peptides and proteins
DA Evans, DJ Wales
J. Chem. Phys.
(2003)
118
Free energy barrier to melting of single-chain polymer crystallite
W Hu, D Frenkel, VBF Mathot
Journal of Chemical Physics
(2003)
118
[1,1′-Bis(diphenylphosphino)ferrocene-κ22P, P′p](1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate dichloromethane disolvate
MD Jones, FAA Paz, JE Davies, BFG Johnson
Acta Crystallographica Section E Structure Reports Online
(2003)
59
(eta(3)-allyl)[(S)-(+)-(2-pyrrolidinylmethyl)pyrrolidine]palladium(II) trifluoromethanesulfonate
MD Jones, FAA Paz, JE Davies, BFG Johnson
Acta Crystallographica Section E: Crystallographic Communications
(2003)
59
The rovibrational levels of ammonia
SM COLWELL, S CARTER, NC HANDY
Molecular Physics
(2003)
101
Online validation and comparison of molfile and CML molecular atom-connection descriptors
GV Gkoutos, HS Rzepa, P Murray-Rust
INTERNET J CHEM
(2003)
6
Infrared laser spectroscopy of the CN free radical in a methane-nitrogen-hydrogen plasma
F HEMPEL, J RÖPCKE, A PIPA, PB DAVIES
Molecular Physics
(2003)
101
The complete folding pathway of a protein from nanoseconds to microseconds.
U Mayor, NR Guydosh, CM Johnson, JG Grossmann, S Sato, GS Jas, SMV Freund, DOV Alonso, V Daggett, AR Fersht
Nature
(2003)
421
Rotational energy transfer in collisions of jet-cooled NO(X 2 Π 1/2 , v =0) with Ar and with He: energy and angular momentum constraints
PA Barrass, P Sharkey, IWM Smith
Physical Chemistry Chemical Physics
(2003)
5
A novel light source for SICM-SNOM of living cells.
AM Rothery, J Gorelik, A Bruckbauer, W Yu, YE Korchev, D Klenerman
J Microsc
(2003)
209
Organic‐Catalyst‐Mediated Cyclopropanation Reaction
CD Papageorgiou, SV Ley, MJ Gaunt
Angewandte Chemie International Edition
(2003)
42
Anharmonic frequencies and Berry pseudorotation motion in PF5
A Caligiana, V Aquilanti, R Burcl, NC Handy, DP Tew
Chemical Physics Letters
(2003)
369
Specific ethene surface activation on silver oxide covered Ag[111] from the interplay of STM experiment and theory.
M-L Bocquet, P Sautet, J Cerda, CI Carlisle, MJ Webb, DA King
Journal of the American Chemical Society
(2003)
125
Kinetics and mechanism of the cyclization of ω-(p-nitrophenyl)hydantoic acid amides: steric hindrance to proton transfer causes a 104-fold change in rate
VT Angelova, AJ Kirby, AH Koedjikov, IG Pojarlieff
Org Biomol Chem
(2003)
1
Transfer hydrogenation using recyclable polyurea-encapsulated palladium: efficient and chemoselective reduction of aryl ketones
J-Q Yu, H-C Wu, C Ramarao, JB Spencer, SV Ley
Chemical Communications
(2003)
3
Aspects of enantioselective heterogeneous catalysis: structure and reactivity of (S)-(-)-1-(1-naphthyl)ethylamine on Pt{111}
JM Bonello, FJ Williams, RM Lambert
Journal of the American Chemical Society
(2003)
125
Different Surface Chemistries of Water on Ru{0001}:  From Monomer Adsorption to Partially Dissociated Bilayers
A Michaelides, A Alavi, DA King
J Am Chem Soc
(2003)
125
The favored cluster structures of model glass formers
JPK Doye, DJ Wales, FHM Zetterling, M Dzugutov
Journal of Chemical Physics
(2003)
118
Reactions of metallated cyclohexyl phosphine (CyPHM) with As(NMe2)(3); synthesis of [(CyP)(4)As](-) anions (M = Li or Na, Cy = cyclohexyl)
A Bashall, F García, AA Hopkins, JA Wood, M McPartlin, AD Woods, DS Wright
Dalton Transactions
(2003)
Energetic and structural analysis of the role of tryptophan 59 in FKBP12.
KF Fulton, SE Jackson, AM Buckle
Biochemistry
(2003)
42