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  • Currently displaying 29021 - 29040 of 30706 publications
Author(s)
Publication title
Journal Name
Publication year
The efficient evaluation of configuration interaction analytic energy second derivatives: Application to hydrogen thioperoxide, HSOH
TJ Lee, NC Handy, JE Rice, AC Scheiner, HF Schaefer
The Journal of Chemical Physics
(1986)
85
Protein engineering.
RJ Leatherbarrow, AR Fersht
"Protein Engineering, Design and Selection"
(1986)
1
Chemical shift tensor analyses and simulations of slow-spinning MAS NMR spectra
NJ Clayden, CM Dobson, L-Y Lian, DJ Smith
Journal of Magnetic Resonance 1969
(1986)
69
Kinetic measurements on the system No + No2 ⇌ N2O3 by time-resolved infrared laser absorption
IWM Smith, G Yarwood
Chemical Physics Letters
(1986)
130
Evidence for Smectic Order in a Fluid of Hard Parallel Spherocylinders
A Stroobants, HN Lekkerkerker, D Frenkel
Physical review letters
(1986)
57
Mechanism for doping in Bi chalcogenide glasses.
SR Elliott, AT Steel
Physical review letters
(1986)
57
Bond length and reactivity: the Beckmann rearrangement. 2. Structure of a protonated lactam: 5-tert-butylhexahydro-2H-azepin-2-onium p-toluensulfonate monohydrate
MR Edwards, HD Holden, AJ Kirby, PR Raithby
Acta Crystallographica Section C: Structural Chemistry
(1986)
42
A stereospecific synthesis of optically active allylsilanes
I Fleming, AP Thomas
Journal of the Chemical Society, Chemical Communications
(1986)
Bond length and reactivity: the Beckmann rearrangement. 3. Structure of 4-phenylcyclohexanone O-(2-naphthalenesulfonyl)oxime at 233 K
PG Jones, MR Edwards, AJ Kirby
Acta Crystallographica Section C Crystal Structure Communications
(1986)
42
Bond length and reactivity: the Beckmann rearrangement. 1. Structure of cyclopentanone O-(3,5-dinitrobenzoyl)oxime n-hexane solvate (4:1)
PG Jones, MR Edwards, AJ Kirby
Acta Crystallographica Section C Crystal Structure Communications
(1986)
42
Bond length and reactivity: the Beckmann rearrangement. 4. Structure of 4‐phenylcyclohexanone oxime O‐triphenylmethyl ether at 233 K
PG Jones, MR Edwards, AJ Kirby
Acta Crystallographica Section C Crystal Structure Communications
(1986)
42
Cyclic and cage ligands of elements of groups 15 and 16
PT Wood, JD Woollins
Transition Metal Chemistry
(1986)
11
On the stability of polydisperse colloidal crystals
JL Barrat, JP Hansen
Journal de Physique
(1986)
47
A study of nitrosyl fluoride
IL Alberts, NC Handy, P Palmieri
Chemical Physics Letters
(1986)
129
THEORETICAL-STUDIES OF ICOSAHEDRAL C60 AND SOME RELATED SPECIES
AJ Stone, DJ Wales
Chemical Physics Letters
(1986)
128
DEFECT FLUORITE STRUCTURES CONTAINING BI2O3 - THE SYSTEM BI2O3-NB2O5
W Zhou, DA Jefferson, JM Thomas
Proceedings of the Royal Society A
(1986)
406
Molecular dynamics simulations of native and substrate-bound lysozyme. A study of the average structures and atomic fluctuations.
CB Post, BR Brooks, M Karplus, CM Dobson, PJ Artymiuk, JC Cheetham, DC Phillips
J Mol Biol
(1986)
190
Binding energy and catalysis: a lesson from protein engineering of the tyrosyl-tRNA synthetase
AR Fersht, RJ Leatherbarrow, TNC Wells
Trends in Biochemical Sciences
(1986)
11
HIGH-RESOLUTION ELECTRON-MICROSCOPIC AND SPECTROSCOPIC STUDY OF SIPOS AND ITS INTERFACE WITH SI
J WONG, DA JEFFERSON, TG SPARROW, JM THOMAS, RH MILNE, A HOWIE, EF KOCH
J ELECTROCHEM SOC
(1986)
133
BENCHMARK FULL CONFIGURATION-INTERACTION CALCULATIONS ON HF AND NH2
CW Bauschlicher, SR Langhoff, PR Taylor, NC Handy, PJ Knowles
The Journal of Chemical Physics
(1986)
85