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  • Currently displaying 28281 - 28300 of 30425 publications
Author(s)
Publication title
Journal Name
Publication year
MODERN ELECTRONIC-STRUCTURE CALCULATIONS - THE ACCURATE PREDICTION OF SPECTROSCOPIC BAND ORIGINS
NC HANDY
SUPERCOMPUTER ALGORITHMS FOR REACTIVITY, DYNAMICS AND KINETICS OF SMALL MOLECULES
(1989)
277
NMR-STUDIES OF PROTEIN DYNAMICS AND FOLDING
CM DOBSON
PROTEIN STRUCTURE AND ENGINEERING
(1989)
183
"NMR Studies of Protein Dynamics and Folding", in Protein structure and engineering
CM Dobson
(1989)
Calculation of the chemical potential in the gibbs ensemble
B Smit, D Frenkel
Molecular Physics
(1989)
68
Computer simulations in the Gibbs ensemble
B Smit, P De Smedt, D Frenkel
Molecular Physics
(1989)
68
ASSEMBLY OF THE T-CELL RECEPTOR CD3 COMPLEX
C TERHORST, B ALARCON, B BERKHOUT, R BLUMBERG, H CLEVERS, K GEORGOPOULOS, C HALL, S LEY, J SANCHO, J VERSTEEGEN, T WILEMAN
PROGRESS IN IMMUNOLOGY, VOL 7
(1989)
skeletal rearrangements in clusters III. applications of vibrational analysis
DJ Wales, DMP Mingos
Polyhedron
(1989)
15
SUBSTITUTION-REACTIONS OF 2-BENZENESULFONYL CYCLIC ETHERS WITH SILYL ENOL ETHERS PROMOTED BY ALUMINUM TRICHLORIDE
S V. Ley, D S. Brown, M Bruno
Heterocycles
(1989)
28
Invited Lecture. Columnar ordering as an excluded-volume effect
D Frenkel
Liquid Crystals
(1989)
5
HYDROTHERMAL ISOMORPHOUS SUBSTITUTION OF BORON IN ZEOLITE ZSM-5 SILICALITE
B SULIKOWSKI, J KLINOWSKI
ACS SYMPOSIUM SERIES
(1989)
398
HIGH-RESOLUTION ELECTRON-MICROSCOPIC STUDIES OF ZEOLITE ZSM-48
AI KIRKLAND, GR MILLWARD, SW CARR, PP EDWARDS, J KLINOWSKI
ACS SYM SER
(1989)
398
SECONDARY SYNTHESIS OF FAUJASITIC CATALYSTS
H HAMDAN, J KLINOWSKI
ACS SYM SER
(1989)
398
Hybridization schemes for clusters
DJ Wales
Mol Phys
(1989)
67
HURLEY,ANDREW,CROWTHER - INTRODUCTORY-REMARKS
AD BUCKINGHAM
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
(1989)
SYNTHESIS OF 3-ETHYL-3-HYDROXY-DELTA-VALEROLACTONE, A HOMOLOG OF MEVALONOLACTONE AND A METABOLITE IN PROPIONIC ACIDEMIA
I FLEMING, SK ARMSTRONG, RJ POLLITT
J CHEM RES-S
(1989)
GRADIENT THEORY - ITS APPLICATION TO THE EXTENDED HARTREE-FOCK METHOD
NC HANDY, JE RICE
QUANTUM CHEMISTRY : BASIC ASPECTS, ACTUAL TRENDS
(1989)
62
Reversible photoinduced change of ac conduction in amorphous As2S3 films.
K Shimakawa, SR Elliott
Physical Review B
(1988)
38
Overtone spectra of C–H oscillators in cold molecules
MW Crofton, CG Stevens, D Klenerman, JH Gutow, RN Zare
The Journal of Chemical Physics
(1988)
89
A polarizable model for water using distributed charge sites
M Sprik, ML Klein
The Journal of Chemical Physics
(1988)
89
The vibrational circular dichroism of dimethylcyclopropane in the C–H stretching region
RD Amos, NC Handy, AF Drake, P Palmieri
The Journal of Chemical Physics
(1988)
89