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  • Currently displaying 23761 - 23780 of 31842 publications
Author(s)
Publication title
Journal Name
Publication year
Calculation of the melting point of NaCl by molecular simulation
J Anwar, D Frenkel, MG Noro
Journal of Chemical Physics
(2003)
118
Structures and thermodynamic phase transitions for oxygen and silver oxide phases on Ag{1 1 1}
A Michaelides, M-L Bocquet, P Sautet, A Alavi, DA King
Chemical Physics Letters
(2003)
367
Self-consistent determination of the transition state for protein folding: Application to a fibronectin type III domain
E Paci, J Clarke, A Steward, M Vendruscolo, M Karplus
Proceedings of the National Academy of Sciences of the United States of America
(2003)
100
Vibrational relaxation of carbon monoxide (4 ≤ v ≤ 11) at 85 K
C Wittig, I Smith
IEEE Journal of Quantum Electronics
(2003)
9
Vibrational relaxation in potentially reactive collisions: Temperature and isotope effects
I Smith
IEEE Journal of Quantum Electronics
(2003)
11
RELAXATION OF HCL(UPSILON = 1) AND DCL(UPSILON = 1) BY CL AND O ATOMS
R Brown, G Glass, I Smith
IEEE Journal of Quantum Electronics
(2003)
11
A Convenient Method for the Synthesis of Dehydroquinic Acid
C Le Sann, C Abell, AD Abell
Synthetic Communications
(2003)
33
A tilt-dependent diffusional potential energy landscape: Benzyne on Ir {1 0 0}
S Yamagishi, SJ Jenkins, DA King
Chemical Physics Letters
(2003)
367
PNA and oligonucleotide inhibitors of human telomerase
S Balasubramanian, G Gavory
(2003)
Cutting edge approaches to drug design
A Bender
Drug Discovery Today Biosilico
(2003)
1
Quantum scattering calculations on chemical reactions.
SC Althorpe, DC Clary
Annual Review of Physical Chemistry
(2003)
54
Sequential Unfolding of Ankyrin Repeats in Tumor Suppressor p16
KS Tang, AR Fersht, LS Itzhaki
Structure (London, England : 1993)
(2003)
11
100 Years of Physical Chemistry: A Celebration of the Faraday Society
IWM Smith
(2003)
Is there a unifying mechanism for protein folding?
V Daggett, AR Fersht
Trends Biochem Sci
(2003)
28
Magnetic resonance in chemistry and medicine
R Freeman
(2003)
Learn-on-the-fly: An adaptive classical/quantum hybrid molecular dynamics scheme
G Csanyi
(2003)
Learn-on-the-fly: an adaptive classical/quantum hybrid molecular dynamics scheme
G Csanyi
(2003)
Data overload
A Bond, J Davies
CHEMISTRY IN BRITAIN
(2003)
39
Short term remodelling of the aorta of cholesterol fed New Zealand White (NZW) rabbits shown by high-resolution magnetic resonance imaging (MRI)
L Hegyi, AL Busza, PD Hockings, JN Skepper, TA Carpenter, GA Whelan, DC Grimsditch, P Overend, GM Benson, DG Reid, KE Suckling, PL Weissberg
Atherosclerosis Plus
(2003)
4
Use of pi-allyltricarbonyliron lactone complexes in the synthesis of taurospongin A: a potent inhibitor of DNA polymerase beta and HIV reverse transcriptase
CJ Hollowood, S Yamanoi, SV Ley
Organic & Biomolecular Chemistry
(2003)
1