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  • Currently displaying 26401 - 26420 of 31148 publications
Author(s)
Publication title
Journal Name
Publication year
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
Polarizability of an electric double-layer
E Trizac, J-P Hansen
Comptes Rendus de l Académie des Sciences - Series IIB - Mechanics-Physics-Chemistry-Astronomy
(1997)
325
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
ASTRONOMY & ASTROPHYSICS
(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
(1997)
56
Understanding Molecular Simulation: From Algorithms to Applications
MA Ratner
Physics Today
(1997)
50
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 2
YJ Tan, M Oliveberg, DE Otzen, AR Fersht
Journal of Molecular Biology
(1997)
269
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: An ab initio quantum chemical study
GB BACSKAY, AD BUCKINGHAM
Molecular Physics
(1997)
91
Properties of fluorophores on solid phase resins; Implications for screening, encoding and reaction monitoring
RH Scott, S Balasubramanian
Bioorganic & 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
How to calculate the true vibrational density of states from inelastic neutron scattering
SN Taraskin, SR Elliott
Physica B: Condensed Matter
(1997)
234
NH-Acidities of Some Sterically Hindered Ureas†
IG Pojarlieff, IB Blagoeva, BP Mikhova, E Atay, AJ Kirby
Journal of Chemical Research Synopses
(1997)
Photoinduced surface deposition of metallic silver in Ag-As-S glasses: Effect of addition of other elements
T Kawaguchi, S Maruno, SR Elliott
Journal of Non Crystalline Solids
(1997)
212