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  • Currently displaying 27001 - 27020 of 29248 publications
Author(s)
Publication title
Journal Name
Publication year
Unlimited full configuration interaction calculations
PJ Knowles, NC Handy
The Journal of Chemical Physics
(1989)
91
Evidence that pyridoxal phosphate modification of lysine residues (Lys-55 and Lys-59) causes inactivation of hydroxymethylbilane synthase (porphobilinogen deaminase)
AD Miller, LC Packman, GJ Hart, PR Alefounder, C Abell, AR Battersby
Biochemical Journal
(1989)
262
Angular-dependent photoselection and anisotropy of optical absorption for photochromic molecules in glassy poly(Methyl methacrylate)
P Jones, P Darcy, GS Attard, WJ Jones, G Williams
Molecular Physics
(1989)
67
A re-examination of multilayer relaxation of Ag(110) by LEED structural analysis
M Lindroos, CJ Barnes, M Valden, DA King
Surface Science
(1989)
218
Benchmark calculations of first principles rotational and ro-vibrational line strenghts
S Carter, P Rosmus, NC Handy, S Miller, J Tennyson, BT Sutcliffe
Computer Physics Communications
(1989)
55
Metal Hydrides as Precursors for the Generation of Supported Metal Particles and Alkali Metal Whiskers
PJ Herley, W Jones
Zeitschrift Fur Physikalische Chemie
(1989)
164
Role of long-range interactions in the melting of a metallic surface.
B Pluis, TN Taylor, D Frenkel, van der Veen JF
Physical review. B, Condensed matter
(1989)
40
Mapping the transition state and pathway of protein folding by protein engineering.
A Matouschek, JT Kellis, L Serrano, AR Fersht
Nature
(1989)
340
Molecular dynamics simulation using hard particles
MP Allen, D Frenkel, J Talbot
Computer Physics Reports
(1989)
9
A numerically stable procedure for calculating Møller-Plesset energy derivatives, derived using the theory of Lagrangians
T Helgaker, P Jørgensen, NC Handy
Theoretical Chemistry Accounts
(1989)
76
INTRAMOLECULAR PROTON-TRANSFER CATALYSIS OF NUCLEOPHILIC CATALYSIS OF ACETAL HYDROLYSIS - THE HYDROLYSIS OF 8-DIMETHYLAMINO-1-METHOXYMETHOXYNAPHTHALENE
AJ Kirby, JM Percy
Journal of the Chemical Society, Perkin Transactions 2
(1989)
The electrostatic model of field gradients at nuclei. An application to hydrogen-bonded complexes of HCl
J Baker, AD Buckingham, PW Fowler, E Steiner, P Lazzereti, R Zanasi
Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics
(1989)
85
Structure and growth of colloidal metal particles
DJ Wales, AI Kirkland, DA Jefferson
Journal of Chemical Physics
(1989)
91
Ionization and phase diagram of classical Thomson atoms on a triangular lattice
P Choquard, B Piller, R Rentsch, J Clérouin, JP Hansen
Phys Rev A Gen Phys
(1989)
40
Defect and phase analysis of scandium hydride by transmission electron microscopy
PJ HERLEY, W JONES
Materials Science Engineering A Structural Materials Properties Microstructure and Processing
(1989)
114
The magnetic hyperpolarizability anisotropy of some two-electron systems
PW Fowler, AD Buckingham
Molecular Physics
(1989)
67
Distribution and dynamics of mobile ions in systems of ordered B-DNA
LE Guldbrand, TR Forester, RM Lynden-Bell
Molecular Physics
(1989)
67
Monte carlo study of rod-like molecules a test of perturbation theory for the kihara model
C Vega, D Frenkel
Molecular Physics
(1989)
67
AL-27 QUADRUPOLE NUTATION NMR-STUDIES OF AMORPHOUS ALUMINOSILICATES
H Hamdan, J Klinowski
Chemical Physics Letters
(1989)
158
A new kind of selective excitation sequence
X-L Wu, P Xu, R Freeman
Journal of Magnetic Resonance (1969)
(1989)
83