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  • Currently displaying 27121 - 27140 of 29855 publications
Author(s)
Publication title
Journal Name
Publication year
AN UNBOUNDED SYSTEMATIC SEARCH OF CONFORMATIONAL SPACE
JM GOODMAN, WC STILL
JOURNAL OF COMPUTATIONAL CHEMISTRY
(1991)
12
ORDER IN COMPLEX-SYSTEMS - THE 1991 NOBEL-PRIZE IN PHYSICS
JP HANSEN
PHYS WORLD
(1991)
4
Gradient theory applied to the Brueckner doubles method
R Kobayashi, NC Handy, RD Amos, GW Trucks, MJ Frisch, JA Pople
The Journal of Chemical Physics
(1991)
95
Bond length variation with coverage for caesium adsorption on Si{111} (7 × 7)
DR Batchelor, DA King
Chemical Physics Letters
(1991)
186
An unbounded systematic search of conformational space
JM Goodman, WC Still
Journal of Computational Chemistry
(1991)
12
Hydrogen bonding and the static dielectric constant in liquid water
M Sprik
The Journal of Chemical Physics
(1991)
95
Diffuse radiation, twilight, and photochemistry ? II
DJ Lary, JA Pyle
Journal of Atmospheric Chemistry
(1991)
13
THE 3-BODY CONTRIBUTION TO THE POLARIZABILITY OF A TRIMER OF INERT-GAS ATOMS USING A DIPOLE INDUCED-DIPOLE MODEL
AD Buckingham, ID Hands
Chemical Physics Letters
(1991)
185
The influence of soft mode adsorbate vibrations on NEXAFS analyses: NO on Pd{110}
J Singh, WK Walter, A Atrei, DA King
Chemical Physics Letters
(1991)
185
Chemistry of insect antifeedants from azadirachta indica (Part 9): oxidative reactions of azadirachtin derivatives leading to C8-C14 bond cleavage.
SV Ley, PJ Lovell, SC Smith, A Wood
Tetrahedron Letters
(1991)
32
Chemistry of insect antifeedants from Azadirachta indica (Part 10): synthesis of a highly functionalised decalin fragment of azadirachtin.
HC Kolb, SV Ley
Tetrahedron Letters
(1991)
32
Open-shell M∅ller—Plesset perturbation theory
RD Amos, JS Andrews, NC Handy, PJ Knowles
Chemical Physics Letters
(1991)
185
Broadband-decoupled proton spectroscopy
P Xu, X-L Wu, R Freeman
Journal of Magnetic Resonance 1969
(1991)
95
High resolution solid-state1H nuclear magnetic resonance spectra of organic template in hydrated aluminophosphate VPI-5
W Kolodziejski, JO Rocha, H He, J Klinowski
Applied Catalysis
(1991)
77
Mapping transition states of protein unfolding by protein engineering of ligand-binding sites
J Sancho, EM Meiering, AR Fersht
J Mol Biol
(1991)
221
Calculation of ion scattering yields from simulated crystal surfaces: theory and application to melting and non-melting Al surfaces
AWD van der Gon, D Frenkel, JWM Frenken, RJ Smith, P Stoltze
Surface Science
(1991)
256
Kinetic Analysis of the Stereochemical Nonrigidity of the Triosmium μ3-Arene/Alkene Complex Os3(CO)8(η2-CH2CH2)(μ3:η2:η2:η2-C6H6) in the Solid State by 13C CP/MAS NMR Spectroscopy
SJ Heyes, CM Dobson, MA Gallop, BFG Johnson, J Lewis
Inorganic Chemistry
(1991)
30
Absorption-mode two-dimensional NMR spectra recorded using pulsed field gradients
AL Davis, ED Laue, J Keeler, D Moskau, J Lohman
Journal of Magnetic Resonance (1969)
(1991)
94
The thorpe-ingold effect in the synthesis of tetrahydro-furans and pyrans by competitive cyclisation with phenylthio migration
S McIntyre, FH Sansbury, S Warren
Tetrahedron Letters
(1991)
32
The analytic gradient of the perturbative triplet excitations correction to the Brueckner doubles method
R Kobayashi, RD Amos, NC Handy
Chemical Physics Letters
(1991)
184