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  • Currently displaying 27321 - 27340 of 29940 publications
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General discussion
IWM Smith, JJ Valentini, DM Neumark, MNR Ashfold, M González, F Temps, A Laganà, JM Alvariño, LM Quintales, JC Polanyi, R Grice, DG Truhlar, KG McKendrick, FJ Aoiz, RS Mackay, Q-X Xu, VW-K Wu, DC Clary, B Soep, G Schatz, MS Child, M Shapiro, AH Zewail, H Metiu, JMC Plane, G Gerber, JE Combariza, J Manz, GK Paramonov, S Görtler, JP Simons, K Morokuma, E Kolba, R Kosloff, F Sondermann, VJ Herrero, VS Rábanos, KH Welge, B Girard, DE Manolopoulos, P Casavecchia, N Balucani, L Beneventi, D Stranges, GG Volpi, JM Bowman, RA Marcus, RT Pack, GA Parker, JNL Connor, DC Chatfield, RS Friedman, MGC Lynch, R Foster, MJ Frost, H Hippler, A Schlepegrell, J Troe, K-H Gericke, MH Alexander, PJ Dagdigian, SG Clement, JD Howe, CM Western, RN Dixon, PJ Sarre
Faraday Discuss. Chem. Soc.
(1991)
91
Structure–activity studies on amides inhibiting photosystem II
RJ Lewis, P Camilleri, AJ Kirby, CA Marby, AA Slawin, DJ Williams
Journal of the Chemical Society, Perkin Transactions 2
(1991)
On the anisotropy of diffusion in nematic liquid crystals:Test of a modified affine transformation model via molecular dynamics
S Hess, D Frenkel, MP Allen
Molecular Physics
(1991)
74
PACKING SCHEMES FOR LENNARD-JONES CLUSTERS OF 13 TO 150 ATOMS - MINIMA, TRANSITION-STATES AND REARRANGEMENT MECHANISMS
J Uppenbrink, DJ Wales
\jcsft
(1991)
87
STRUCTURE AND DYNAMICS OF REACTIVE TRANSITION-STATES - GENERAL DISCUSSION
A HODGSON, BE HAYDEN, DG TRUHLAR, R RANDALL, T TRUONG, AW KLEYN, J MANZ, MH ALEXANDER, S HOLLOWAY, AD BUCKINGHAM, ST CEYER, JJ VALENTINI, M SHAPIRO, MHP ARDEBILI, CJ HUGHES, JC WHITEHEAD, R GRICE, MA CHESTERS, JC POLANYI, RA MARCUS, H METIU, AH ZEWAIL
FARADAY DISCUSS
(1991)
91
STABILIZATION OF BARNASE BY AN INTERACTION BETWEEN 2 OPPOSITELY CHARGED SIDE-CHAINS
D SALI, M BYCROFT, AR FERSHT
TECHNIQUES IN PROTEIN CHEMISTRY II
(1991)
METHODS FOR CALCULATING INTERMOLECULAR POTENTIAL-ENERGY SURFACES
AJ STONE
HYDROGEN-BONDED LIQUIDS
(1991)
329
Energy and structure of the transition states in the reaction OH + CO → H + CO 2
MJ Frost, P Sharkey, IWM Smith
Faraday Discussions
(1991)
91
TAGGED PARTICLE DIFFUSION IN 3D LATTICE GAS CELLULAR AUTOMATA
MA Van Der Hoef, D Frenkel
Physica D: Nonlinear Phenomena
(1991)
47
Vapour-liquid equilibria of the hard core yukawa fluid
B Smit, D Frenkel
Molecular Physics
(1991)
74
THE CALCULATION OF INTERMOLECULAR POTENTIALS
AJ STONE
ADVANCES IN BIOMOLECULAR SIMULATIONS
(1991)
239
Geminal-filtered correlation spectroscopy
T Domke, P Xu, R Freeman
Journal of Magnetic Resonance 1969
(1991)
92
Isomorphous substitution in non-linear optical KTiOPO4. Powder diffraction and magic angle spinning nuclear magnetic resonance study of (K½Na½)TiOPO4and (Rb½Na½)TiOPO4
SJ Crennell, JJ Owen, CP Grey, AK Cheetham, JA Kaduk, RH Jarman
J. Mater. Chem.
(1991)
1
Terpenoid biosynthesis and the stereochemistry of enzyme-catalysed allylic addition-elimination reactions
DE Cane, C Abell, PHM Harrison, BR Hubbard, CT Kane, R Lattman, JS Oliver, SW Weiner
(1991)
332
SYNTHESIS OF TETRAHYDROPYRAN-CONTAINING NATURAL-PRODUCTS
SV LEY
HETEROCYCLES IN BIO-ORGANIC CHEMISTRY
(1991)
NOVEL ROUTES TO INOSITOL PHOSPHATES USING PSEUDOMONAS-PUTIDA OXIDATION OF ARENES
SV LEY, AJ REDGRAVE, LL YEUNG
INOSITOL PHOSPHATES AND DERIVATIVES
(1991)
463
Surface oxide films and H2/CO chemisorption at the Ru/TiO2 interface: Studies with a model planar catalyst
JPS Badyal, RM Lambert
Journal of Catalysis
(1991)
130
Oxygen surface species on lithium nickelate methane coupling catalysts and their interaction with carbon oxides
GD Moggridge, JPS Badyal, RM Lambert
Journal of Catalysis
(1991)
132
SYNTHESIS OF INSECT ANTIFEEDANTS
SV LEY
PESTICIDE CHEMISTRY : ADVANCES IN INTERNATIONAL RESEARCH, DEVELOPMENT, AND LEGISLATION
(1991)
PLASMA SIMULATIONS USING THE CAR-PARRINELLO METHOD
J CLEROUIN, G ZERAH, JP HANSEN
COMPUTER SIMULATION IN MATERIALS SCIENCE
(1991)
205