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  • Currently displaying 20541 - 20560 of 29677 publications
Author(s)
Publication title
Journal Name
Publication year
Line strengths and transition dipole moment of the nu2 fundamental band of the methyl radical.
GD Stancu, J Röpcke, PB Davies
Journal of Chemical Physics
(2004)
122
Resolution of (S,S)-4-(2,2,4-trimethylchroman-4-yl)phenyl camphanate and its 4-chromanyl epimer by crystallization.
C Esterhuysen, MW Bredenkamp, GO Lloyd
Acta Crystallographica Section C Crystal Structure Communications
(2004)
61
Scientific biography
NC Handy
Molecular Physics
(2004)
102
The molecular physics lecture 2004: (i) Density functional theory, (ii) Quantum Monte Carlo
NC Handy
Molecular Physics
(2004)
102
Speed-up of Monte Carlo simulations by sampling of rejected states.
D Frenkel
Proc Natl Acad Sci U S A
(2004)
101
The Hydrophobic Effect as a Driving Force in the Self‐Assembly of a [2×2] Copper(I) Grid
JR Nitschke, M Hutin, G Bernardinelli
Angewandte Chemie
(2004)
116
The hydrophobic effect as a driving force in the self-assembly of a [2 x 2] copper(I) grid.
JR Nitschke, M Hutin, G Bernardinelli
Angewandte Chemie International Edition
(2004)
43
What Is the Smallest Saturated Acyclic Alkane that Cannot Be Made?.
KMN de Silva, JM Goodman
J. Chem. Inf. Model.
(2004)
45
Reactions of Potent Antitumor Complextrans-[RuIIICl4(indazole)2]-with a DNA-Relevant Nucleobase and Thioethers:  Insight into Biological Action
A Egger, VB Arion, E Reisner, B Cebrián-Losantos, S Shova, G Trettenhahn, BK Keppler
Inorganic Chemistry
(2004)
44
Total synthesis of the Fusarium toxin equisetin
LT Burke, DJ Dixon, SV Ley, F Rodríguez
Organic and Biomolecular Chemistry
(2004)
3
Molecular dynamics simulations of GlpF in a micelle vs in a bilayer: conformational dynamics of a membrane protein as a function of environment.
G Patargias, PJ Bond, SS Deol, MSP Sansom
The journal of physical chemistry. B
(2004)
109
Adsorption of atmospherically relevant gases at the air/water interface: Free energy profiles of aqueous solvation of N 2, O 2, O 3, OH, H 2O, HO 2, and H 2O 2
R Vácha, P Slavíček, M Mucha, BJ Finlayson-Pitts, P Jungwirth
Journal of Physical Chemistry A
(2004)
108
Phi value versus psi analysis.
AR Fersht
Proceedings of the National Academy of Sciences
(2004)
101
A Second-Generation Total Synthesis of (+)-Discodermolide:  The Development of a Practical Route Using Solely Substrate-Based Stereocontrol
I Paterson, O Delgado, GJ Florence, I Lyothier, M O'Brien, JP Scott, N Sereinig
The Journal of organic chemistry
(2004)
70
Nickel formate route to the growth of carbon nanotubes
J Geng, H Li, VB Golokov, DS Shephard, DA Jefferson, BFG Johnson, S Hofmann, B Kleinsorge, J Robertson, C Ducati
Journal of Physical Chemistry B
(2004)
108
13C and 2D WISE NMR studies of the host mobility in two aromatic complexes of p-tert-butyl-calixarene
F Benevelli, YZ Khimyak, J Klinowski
Journal of inclusion phenomena and macrocyclic chemistry
(2004)
49
Vertical transport and degradation of polycyclic aromatic hydrocarbons in an Alpine Valley
M Kalberer, S Henne, ASH Prevot, M Steinbacher
Atmospheric Environment
(2004)
38
Controllable donor-acceptor neutral [2]rotaxanes
T Iijima, SA Vignon, H-R Tseng, T Jarrosson, JKM Sanders, F Marchioni, M Venturi, E Apostoli, V Balzani, JF Stoddart
Chemistry (Weinheim an der Bergstrasse, Germany)
(2004)
10
Characterisation and evaluation of hypothetical zeolite frameworks
RG Bell, MD Foster, A Simperler, J Klinowski
Studies in Surface Science and Catalysis
(2004)
154
Ternary half-metallics and related binary compounds: Stoichiometry, surface states, and spin
SJ Jenkins
Physical Review B Condensed Matter and Materials Physics
(2004)
70