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  • Currently displaying 24101 - 24120 of 30214 publications
Author(s)
Publication title
Journal Name
Publication year
Perspective on "Statistical mechanical theory of irreversible processes. I. General theory and simple applications to magnetic and conduction problems."
D Frenkel
Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)
(2000)
103
Phenomenological damping in optical response tensors - art. no. 035801
AD Buckingham, P Fischer
Physical Review A
(2000)
61
Selective oxygen capture to give a unique mixed-anion lithium aluminate:: the synthesis and solid-state structure of {[PhC(O)N(Me)Al(Me)(But)OMe]Li•[PhC(O)N(Me)Al(Me)(OBut)OMe]Li}2
RP Davies, DJ Linton, R Snaith, AEH Wheatley
Chemical Communications
(2000)
Mechanistic studies on type I and type II dehydroquinase with (6R)- and (6S)-6-fluoro-3-dehydroquinic acids.
EJ Parker, C González Bello, JR Coggins, AR Hawkins, C Abell
Bioorg Med Chem Lett
(2000)
10
Adsorbate/substrate bonding in Co{1010}/K-c(2 X 2) elucidated through first-principles theory
SJ Jenkins, DA King
Chemical Physics Letters
(2000)
317
Near-infrared laser absorption spectroscopy of the CS+ cation
Y Liu, H Liu, H Gao, C Duan, PA Hamilton, PB Davies
Chemical Physics Letters
(2000)
317
Pentaprismane and hypostrophene from first-principles, with plane waves
SJ Jenkins, DA King
Chemical Physics Letters
(2000)
317
Polymer supported reagents in synthesis: preparation of bicyclo[2.2.2] octane derivates via Tandem Michael addition reactions and subsequent combinatorial decoration.
SV Ley, A Massi
J Comb Chem
(2000)
2
NO Chemisorption and Reactions on Metal Surfaces:  A New Perspective
WA Brown, DA King
Journal of Physical Chemistry B
(2000)
104
Mechanism of rescue of common p53 cancer mutations by second-site suppressor mutations.
PV Nikolova, KB Wong, B DeDecker, J Henckel, AR Fersht
EMBO Journal
(2000)
19
Crystallization and phase separation in nonadditive binary hard-sphere mixtures
AA Louis, R Finken, JP Hansen
Phys Rev E Stat Phys Plasmas Fluids Relat Interdiscip Topics
(2000)
61
Nonlinear Poisson-Boltzmann theory of a Wigner-Seitz model for swollen clays
Leote De Carvalho RJ, E Trizac, J Hansen
Physical Review E
(2000)
61
Structure and stability of the platinum/aluminium interface: alloying and substrate vacancy formation on Pt{111}/Al
AF Lee, K Wilson, RM Lambert
Surface Science
(2000)
446
Rapid assembly of oligosaccharides: 1,2-diacetal-mediated reactivity tuning in the coupling of glycosyl fluorides
DK Baeschlin, LG Green, MG Hahn, B Hinzen, SJ Ince, SV Ley
Tetrahedron: Asymmetry
(2000)
11
Characterization of Proton-Transfer Catalysis by Serum Albumins
F Hollfelder, AJ Kirby, DS Tawfik, K Kikuchi, D Hilvert
Journal of the American Chemical Society
(2000)
122
Macrocyclization and Molecular Interlocking via Mitsunobu Alkylation:  Highlighting the Role of C−H···O Interactions in Templating
JG Hansen, N Feeder, DG Hamilton, MJ Gunter, J Becher, JK Sanders
Org Lett
(2000)
2
Folding Lennard-Jones proteins by a contact potential
C Clementi, M Vendruscolo, A Maritan, E Domany
Proteins Structure Function and Bioinformatics
(2000)
37
Structural Consequences of b- to c-type Heme Conversion in Oxidized Escherichia coli Cytochrome b562,
F Arnesano, L Banci, I Bertini, S Ciofi-Baffoni, TL Woodyear, CM Johnson, PD Barker
Biochemistry
(2000)
39
Reaction of gaseous oxygen with adsorbed carbon on Pt{110}(1 × 2)
AV Walker, DA King
The Journal of Chemical Physics
(2000)
112
New generalized gradient approximation functionals
AD Boese, NL Doltsinis, NC Handy, M Sprik
The Journal of Chemical Physics
(2000)
112