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  • Currently displaying 25101 - 25120 of 29867 publications
Author(s)
Publication title
Journal Name
Publication year
Global Optimization by Basin-Hopping and the Lowest Energy Structures of Lennard-Jones Clusters Containing up to 110 Atoms
DJ Wales, JPK Doye
The Journal of Physical Chemistry A
(1997)
101
Infrared laser absorption spectroscopy of rotational and vibration rotational transitions of HeH+ up to the dissociation threshold
Z Liu, PB Davies
Journal of Chemical Physics
(1997)
107
Detection of residue contacts in a protein folding intermediate
J Balbach, V Forge, WS Lau, JA Jones, NA van Nuland, CM Dobson
Proceedings of the National Academy of Sciences
(1997)
94
Molybdenum(II)-catalyzed allylic substitution
AV Malkov, I Baxendale, DJ Mansfield, P Kočovsky
Tetrahedron Letters
(1997)
38
The promotion of air oxidation and carbonyl substitution reactions of [(eta(5)-C5H5)(2)Mo-2(CO)(4)(mu-RCCR')] by trimethylamine N-oxide or nitrosonium tetrafluoroborate: The synthesis of [(eta(5)-C5H5)(2)Mo-2(O)(2)(mu-O)(mu-RCCR')] (R=R'=CO2Me or Ph; R=H, R'=Ph; or R=H, R'=CO2Me) and [(eta(5)-C5H5)(2)Mo-2(CO)(3)(NO)(mu-RCCR')][BF4] (R=R'=CO2Me, Me or H; or R=H, R'=CO2Me)
JC Stichbury, MJ Mays, JE Davies, PR Raithby, GP Shields
Dalton Transactions
(1997)
The aggregation of methane in aqueous solution
RL Mancera, AD Buckingham, NT Skipper
Journal of the Chemical Society, Faraday Transactions
(1997)
93
Polymer Supported Perruthenate (PSP): A new oxidant for clean organic synthesis
B Hinzen, SV Ley
Journal of the Chemical Society Perkin Transactions 1
(1997)
The role of Glu73 of barnase in catalysis and the binding of barstar.
G Schreiber, C Frisch, AR Fersht
Journal of Molecular Biology
(1997)
270
Total and state-to-state rate coefficients for rotational energy transfer in collisions between NO(X2Π) and He at temperatures down to 15 K
PL James, IR Sims, IWM Smith
Chemical Physics Letters
(1997)
272
Hydrogen exchange in chymotrypsin inhibitor 2 probed by mutagenesis11Edited by J.Karn
JL Neira, LS Itzhaki, DE Otzen, B Davis, AR Fersht
Journal of Molecular Biology
(1997)
270
Hydrogen exchange in chymotrypsin inhibitor 2 probed by denaturants and temperature.
LS Itzhaki, JL Neira, AR Fersht
Journal of molecular biology
(1997)
270
Synthesis and characterization of the mesoporous silicate molecular sieve MCM-48
AA Romero, MD Alba, W Zhou, J Klinowski
The Journal of Physical Chemistry B
(1997)
101
Understanding molecular simulation
D Frenkel, B Smit, J Tobochnik, SR McKay, W Christian
(1997)
11
Reactions of the methylidine radical with CH4, C(2)H(2)r C2H4, C2H6, and but-1-ene studied between 23 and 295 K with a CRESU apparatus
A Canosa, IR Sims, D Travers, IWM Smith, BR Rowe
ASTRON ASTROPHYS
(1997)
323
Effects of three-body (Axilrod-Teller) forces on the classical and quantum behavior of rare-gas trimers
C Chakravarty, RJ Hinde, DM Leitner, DJ Wales
Physical Review E Statistical Physics Plasmas Fluids and Related Interdisciplinary Topics
(1997)
56
Polarisabilité d'une double-couche chargée
E Trizac, J-P Hansen
Comptes Rendus de l'Académie des Sciences - Series IIB - Mechanics-Physics-Chemistry-Astronomy
(1997)
325
Importance of electrostatic interactions in the rapid binding of polypeptides to GroEL
S Perrett, R Zahn, G Stenberg, AR Fersht
Journal of molecular biology
(1997)
269
In situ NMR studies of the conversion of methanol into gasoline on aluminosilicate and gallosilicate offretites
MD Alba, AA Romero, ML Occelli, J Klinowski
The Journal of Physical Chemistry B
(1997)
101
Nucleophilic substitution vs. acid–base reactions of [Mn{N(SiMe 3 ) 2 } 2 ]·2thf; syntheses and structures of 2[Li(thf) 4 ] + [Mn(C 12 H 8 N) 4 ] 2- ·C 6 H 5 Me and [Mn(C 12 H 8 N) 2 ]·3thf (thf = tetrahydrofuran, C 12 H 8 N = carbazol-9-yl)
MA Beswick, CN Harmer, PR Raithby, A Steiner, KL Verhorevoort, DS Wright
Journal of the Chemical Society Dalton Transactions
(1997)
The rate of isomerisation of peptidyl-proline bonds as a probe for interactions in the physiological denatured state of chymotrypsin inhibitor 211Edited by J. Karn
YJ Tan, M Oliveberg, DE Otzen, AR Fersht
Journal of molecular biology
(1997)
269