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  • Currently displaying 26341 - 26360 of 31086 publications
Author(s)
Publication title
Journal Name
Publication year
The role of Glu73 of barnase in catalysis and the binding of barstar
G Schreiber, C Frisch, AR Fersht
J Mol Biol
(1997)
270
Hydrogen exchange in chymotrypsin inhibitor 2 probed by denaturants and temperature.
LS Itzhaki, JL Neira, AR Fersht
J Mol Biol
(1997)
270
Total and state-to-state rate coefficients for rotational energy transfer in collisions between NO(Chi(2)Pi) and He at temperatures down to 15 K
PL James, IR Sims, IWM Smith
Chemical Physics Letters
(1997)
272
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: From algorithms to applications
MA Ratner
Physics Today
(1997)
50
Understanding molecular simulation
D Frenkel, B Smit, J Tobochnik, SR McKay, W Christian
(1997)
11
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
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
ASTRONOMY & ASTROPHYSICS
(1997)
323
Importance of electrostatic interactions in the rapid binding of polypeptides to GroEL 1 1Edited by J. Karn
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
Journal of Physical Chemistry B
(1997)
101
Nucleophilic substitution vs acid-base reactions of [Mn{N(SiMe3)(2)}(2)]center dot 2thf; Syntheses and structures of 2[Li(thf)(4)](+)[Mn(C12H8H)(4)](2-)center dot C6H5Me and [Mn(C12H8N)(2)]center dot 3thf (thf equals tetrahydrofuran, C12H8N equals carbazol-9-yl)
MA Beswick, CN Harmer, PR Raithby, A Steiner, KL Verhorevoort, DS Wright
Journal of the Chemical Society Dalton Transactions
(1997)
Constrained minimizations for the calculation of Kohn-Sham and natural orbitals
BDJ TOZER, NC HANDY, P PALMIERI
Molecular Physics
(1997)
91
Nuclear quadrupole coupling constants in alkali halide molecules: anab initioquantum chemical study
GB BACSKAY, AD BUCKINGHAM
Molecular Physics
(1997)
91
The rate of isomerisation of peptidyl-proline bonds as a probe for interactions in the physiological denatured state of chymotrypsin inhibitor 2
YJ Tan, M Oliveberg, DE Otzen, AR Fersht
J Mol Biol
(1997)
269
Properties of fluorophores on solid phase resins; Implications for screening, encoding and reaction monitoring
RH Scott, S Balasubramanian
Bioorganic and Medicinal Chemistry Letters
(1997)
7
Studies towards the synthesis of the zaragozic acids: Synthesis of the bicyclic acetal core of zaragozic acid C
I Paterson, K Fessner, MRV Finlay
Tetrahedron Letters
(1997)
38
Electrical-conductivity calculation in ab initio simulations of metals: Application to liquid sodium
PL Silvestrelli, A Alavi, M Parrinello
Physical Review B
(1997)
55
Studies in macrolide synthesis: Stereocontrolled synthesis of a C-1-C-13 segment of concanamycin A.
I Paterson, MD McLeod
Tetrahedron Letters
(1997)
38
Demixing in hard ellipsoid rod-plate mixtures
PJ Camp, MP Allen, PG Bolhuis, D Frenkel
Journal of Chemical Physics
(1997)
106