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  • Currently displaying 22561 - 22580 of 30212 publications
Author(s)
Publication title
Journal Name
Publication year
The development of versions 3 and 4 of the Cambridge Structural Database System
FH Allen, JE Davies, JJ Galloy, O Johnson, O Kennard, CF Macrae, EM Mitchell, GF Mitchell, JM Smith, DG Watson
Journal of Chemical Information and Computer Sciences
(2002)
31
Matching Two-Dimensional Chemical Graphs Using Genetic Algorithms
RD Brown, G Jones, P Willett, RC Glen
Journal of Chemical Information and Computer Sciences
(2002)
34
PHARMACOPHORIC PATTERN-MATCHING IN PILES OF 3-DIMENSIONAL CHEMICAL STRUCTURES - COMPARISON OF CONFORMATIONAL-SEARCHING ALGORITHMS FOR FLEXIBLE SEARCHING
DE Clark, G Jones, P Willett, PW Kenny, RC Glen
Journal of Chemical Information and Computer Sciences
(2002)
34
The use of mixed crystals for engineering organic solid-state reactions: application to benzylbenzylidenecyclopentanones
CR Theocharis, GR Desiraju, W Jones
Journal of the American Chemical Society
(2002)
106
Motional Averaging of Proton Nuclear Overhauser Effects in Proteins. Predictions from a Molecular Dynamics Simulation of Lysozyme
ET Olejniczak, CM Dobson, M Karplus, RM Levy
Journal of the American Chemical Society
(2002)
106
A P-31 MAGIC ANGLE SPINNING NMR-STUDY OF THE CATION DISTRIBUTION IN ZN3-XMGX(PO4)2
RJB Jakeman, AK Cheetham, NJ Clayden, CM Dobson
Journal of the American Chemical Society
(2002)
107
Coordination chemistry and geometries of some 4,4'-bipyridyl-capped porphyrins. Proton- and ligand-induced switching of conformations
RJ Abraham, P Leighton, JKM Sanders
Journal of the American Chemical Society
(2002)
107
Anatomy of an SN1 reaction. Crystal structure-reactivity correlations for 1-arylethanol derivatives
MR Edwards, PG Jones, AJ Kirby
Journal of the American Chemical Society
(2002)
108
Preparation of copper organometallics via nucleophilic substitution of CpCuPPh3: syntheses and x-ray structure determinations of [Li(THF)4]+[(fluorenyl)2CuPPh3]- and [Cy3PCu(.mu.-C.tplbond.CtBu)2Cu(PPh3)2] (THF = tetrahydrofuran, fluorenyl = C13H9)
AJ Edwards, MA Paver, PR Raithby, M-A Rennie, CA Russell, DS Wright
Organometallics
(2002)
13
Metalations of 1-aminonaphthalene with trimethylaluminum and with diethylzinc: syntheses and crystal structures of cyclobutane-like [Me2Al(N(H)naphthyl)]2 and cyclohexane-like [EtZn(N(H)naphthyl).cntdot.THF]3
MG Davidson, D Elilio, SL Less, A Martin, PR Raithby, R Snaith, DS Wright
Organometallics
(2002)
12
MEASUREMENT OF HETERONUCLEAR COUPLING-CONSTANTS IN ORGANOMETALLIC COMPLEXES USING HIGH-RESOLUTION 2D NMR
N Bampos, LD Field, BA Messerle
Organometallics
(2002)
12
A trimeric, chair-shaped zinc dialkylphosphine complex: synthesis and structure of {[Zn(Et)(.mu.-PCy2)]3.THF}.2THF [Cy = cyclohexyl (C6H11)]
AJ Edwards, MA Paver, PR Raithby, CA Russell, DS Wright
Organometallics
(2002)
12
Molecular pathways in the cyclotrimerization of ethyne on palladium: role of the C4 intermediate
CH Patterson, RM Lambert
Journal of the American Chemical Society
(2002)
110
Synthesis of polyoxometalate pillared layered double hydroxides via calcined precursors
K Chibwe, W Jones
Chemistry of Materials
(2002)
1
An Ab Initio Approach to Crystal Structure Determination Using High-Resolution Powder Diffraction and Computational Chemistry Techniques: Application to 6,13-Dichlorotriphendioxazine
PG Fagan, RB Hammond, KJ Roberts, R Docherty, AP Chorlton, W Jones, GD Potts
Chemistry of Materials
(2002)
7
6Li MAS NMR Studies of the Local Structure and Electrochemical Properties of Cr-doped Lithium Manganese and Lithium Cobalt Oxide Cathode Materials for Lithium-Ion Batteries
C Pan, YJ Lee, B Ammundsen, CP Grey
Chemistry of Materials
(2002)
14
Synthesis and X-ray crystal structures of bis(3-hydroxy-4-methyl-2(3H)-thiazolethiolato-S-2,O)bis(dimethylsulfoxide-O)M, M=cobalt(II) and nickel(II)
AD Bond, W Jones
Transition Metal Chemistry
(2002)
27
Ionic Solvation in Nonaqueous Solvents: The Structure of Li+ and Cl- in Methanol, Ammonia, and Methylamine
RW Impey, M Sprik, ML Klein
Journal of the American Chemical Society
(2002)
109
THEORY OF VIBRATIONAL CIRCULAR-DICHROISM - TRANS-1(S),2(S)-DICYANOCYCLOPROPANE
KJ Jalkanen, PJ Stephens, RD Amos, NC Handy
Journal of the American Chemical Society
(2002)
109
Reactions of ammonium salts with butyllithium and with lithium hydride: new routes to fully anhydrous inorganic lithium complexes
D Barr, R Snaith, DS Wright, RE Mulvey, K Wade
Journal of the American Chemical Society
(2002)
109