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  • Currently displaying 25381 - 25400 of 30180 publications
Author(s)
Publication title
Journal Name
Publication year
Novel Monte Carlo approach to the dynamics of fluids: Single-particle diffusion, correlation functions, and phase ordering of binary fluids - Comment
CP Lowe, R van Roij, D Frenkel
Physical Review Letters
(1997)
79
The effect of circularly polarized light on NMR spectra
AD BUCKINGHAM, LC PARLETT
Molecular Physics
(1997)
91
The radiative association of CH with H-2: A mechanism for formation of CH3 in interstellar clouds
RA Brownsword, IR Sims, IWM Smith, DWA Stewart, A Canosa, BR Rowe
The Astrophysical Journal
(1997)
485
From hydrophobic to hydrophilic behaviour: A simulation study of solvation entropy and free energy of simple solutes
RM Lynden-Bell, JC Rasaiah
Journal of Chemical Physics
(1997)
107
Triple-quantum Al-27 and Na-23 MAS NMR study of amphiboles
L Delevoye, S Liu, MD Welch, C Fernandez, J-P Amoureux, J Klinowski
Journal of the Chemical Society Faraday Transactions
(1997)
93
Density Functional Theory-Based Molecular Dynamics Simulation of Acid-Catalyzed Chemical Reactions in Liquid Trioxane
A Curioni, M Sprik, W Andreoni, H Schiffer, J Hutter, M Parrinello
Journal of the American Chemical Society
(1997)
119
Temperature dependence of the ClO concentration near the stratopause
S Ghosh, JA Pyle, P Good
Journal of Geophysical Research: Atmospheres
(1997)
102
A residue-specific NMR view of the non-cooperative unfolding of a molten globule.
BA Schulman, PS Kim, CM Dobson, C Redfield
Nature Structural Biology
(1997)
4
Correlation potentials and functionals in Hartree-Fock-Kohn-Sham theory
GK-L Chan, DJ Tozer, NC Handy
The Journal of Chemical Physics
(1997)
107
Numerical study of the phase behavior of rodlike colloids with attractive interactions
PG Bolhuis, A Stroobants, D Frenkel, HNW Lekkerkerker
The Journal of Chemical Physics
(1997)
107
Retrieval of NO2 vertical profiles from ground‐based UV‐visible measurements: Method and validation
KE Preston, RL Jones, HK Roscoe
Journal of Geophysical Research: Atmospheres
(1997)
102
A comparison of the folding kinetics and thermodynamics of two homologous fibronectin type III modules
KW Plaxco, C Spitzfaden, ID Campbell, CM Dobson
Journal of Molecular Biology
(1997)
270
Amorphous materials - Editorial overview
S Elliott, R Street
Current Opinion in Solid State and Materials Science
(1997)
2
Tandem 1,3-azaprotio cyclotransfer-cycloaddition reactions between ketoximes and divinyl ketone or its equivalents: Lewis acid mediated rate enhancement and control of cycloaddition regioselectivity.
IS Saba, M Frederickson, R Grigg, PJ Dunn, PC Levett
Tetrahedron Lett.
(1997)
38
Folding and stability of a fibronectin type III domain of human tenascin.
J Clarke, SJ Hamill, CM Johnson
J Mol Biol
(1997)
270
Quantum mechanics in chemistry - Simons,J, Nichols,J
NC Handy, D Palmer
Nature
(1997)
388
Anharmonic constants for benzene
NC Handy, A Willetts
Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy
(1997)
53
Ab initio molecular dynamics of ion solvation. The case of Be2+ in water
D Marx, M Sprik, M Parrinello
Chemical Physics Letters
(1997)
273
Structural and Dynamical Properties of a Denatured Protein. Heteronuclear 3D NMR Experiments and Theoretical Simulations of Lysozyme in 8 M Urea †
H Schwalbe, KM Fiebig, M Buck, JA Jones, SB Grimshaw, A Spencer, SJ Glaser, LJ Smith, CM Dobson
Biochemistry
(1997)
36
On the shapes of newton's revolving orbits
D Lynden-Bell, RM Lynden-Bell
Notes and Records of the Royal Society
(1997)
51