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  • Currently displaying 25561 - 25580 of 30372 publications
Author(s)
Publication title
Journal Name
Publication year
The structure of the surfactant-water interface for sodium octanoate micelles: A molecular dynamics study using polarizable models.
JC Shelley, M Sprik, ML Klein
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(1997)
214
Development and validation of a genetic algorithm for flexible ligand docking
G Jones, P Willett, RC Glen, AR Leach, R Taylor
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(1997)
214
Displaced metal surface sum frequency spectroscopy of adsorbates at the mica/liquid interface.
AM Briggs, EW Usadi, PB Davies
ABSTR PAP AM CHEM S
(1997)
214
Continued-fraction expansions for the Riemann zeta function and polylogarithms
D Cvijović, J Klinowski
Proceedings of the American Mathematical Society
(1997)
125
Wigner-Seitz model of charged lamellar colloidal dispersions
E Trizac, J-P Hansen
Physical Review E
(1997)
56
Applications of inverse Raman spectroscopy for the study of the structures of liquid crystals
A Grofcsik, M Kubinyi, J Baran, WJ Jones
Magyar Kemiai Folyoirat Kemiai Kozlemenyek
(1997)
103
X=Y-ZH systems as potential 1,3-dipoles. Part 47. Tandem nucleophilic substitution/1,3 dipolar cycloaddition reactions of oximes with epoxides and dipolarophiles.
J Markandu, HA Dondas, M Frederickson, R Grigg
Tetrahedron
(1997)
53
What is the longest unbranched alkane with a linear global minimum conformation?
JM Goodman
J. Chem. Inf. Comput. Sci.
(1997)
37
Reactions of size-selected positively charged nickel clusters with carbon monoxide in molecular beams
Š Vajda, S Wolf, T Leisner, U Busolt, LH Wöste, DJ Wales
Journal of Chemical Physics
(1997)
107
State-to-state reaction probabilities from the time-independent wavepacket reactant - Product decoupling equations: Application to the three-dimensional H + H2 reaction (for J = 0)
SC Althorpe, DJ Kouri, DK Hoffman
Chemical Physics Letters
(1997)
275
Acidity and Catalytic Properties of Realuminated Zeolite Y
B Sulikowski, J Datka, B Gil, J Ptaszynski, J Klinowski
Journal of Physical Chemistry B
(1997)
101
Fluorine-atom initiated oxidation of CF3CF2H (HFC-125) studied by FTIR spectroscopy: product yields and kinetic modelling
AS Hasson, CM Moore, IWM Smith
Journal of the Chemical Society, Faraday Transactions
(1997)
93
Rate constants for the reaction between OH and CH3ONO2 and C2H5ONO2 over a range of pressure and temperature
DE Shallcross, P Biggs, CE Canosa-Mas, KC Clemitshaw, MG Harrison, MRL Alañón, JA Pyle, A Vipond, RP Wayne
Journal of the Chemical Society Faraday Transactions
(1997)
93
Automated ground-based star-pointing UV-visible spectrometer for stratospheric measurements
HK Roscoe, WH Taylor, JD Evans, AM Tait, R Freshwater, D Fish, EK Strong, RL Jones
Applied optics
(1997)
36
3-(1,8-naphthalenedicarboximido)benzonitrile [or N-(3-cyanophenyl)-1,8-naphthalimide], C19H10N2O2
RA Batchelor, CA Hunter, J Simpson
Acta Crystallographica Section C: Structural Chemistry
(1997)
53
Theoretical studies of atomic vibrations on theSi(001)(2×1)surface
HM Tütüncü, SJ Jenkins, GP Srivastava
Physical Review B Condensed Matter and Materials Physics
(1997)
56
Structural, dynamical, electronic, and bonding properties of laser-heated silicon: Anab initiomolecular-dynamics study
PL Silvestrelli, A Alavi, M Parrinello, D Frenkel
Physical Review B Condensed Matter and Materials Physics
(1997)
56
Circular dichroism of denatured barstar suggests residual structure
B Nölting, R Golbik, AS Soler-González, AR Fersht
Biochemistry
(1997)
36
Studies in marine macrolide synthesis: Stereocontrolled synthesis of the F-ring subunit of spongistatin 1 (altohyrtin A).
I Paterson, LE Keown
Tetrahedron Letters
(1997)
38
Comment on “Novel monte carlo approach to the dynamics of fluids: Single-particle diffusion, correlation functions, and phase ordering of binary fluids”
CP Lowe, R van Roij, D Frenkel
Physical Review Letters
(1997)
79