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  • Currently displaying 24121 - 24140 of 29625 publications
Author(s)
Publication title
Journal Name
Publication year
Does density functional theory contribute to the understanding of excited states of unsaturated organic compounds?
DJ Tozer, RD Amos, NC Handy, BO Roos, L Serrano-ANDRES
Molecular Physics
(1999)
97
Infrared laser velocity modulation spectrum of the ν3 fundamental band of HBCI+
NT Hunt, Z Liu, PB Davies
Molecular Physics
(1999)
97
Effect of proton motion on molecular properties in the BrH ··· NH3 complex
AM Aicken, AD Buckingham, Y Tantirungrotechai
Molecular Physics
(1999)
97
Tritiated dihydroazadirachtin binging to Schistocerca gregaria testes and Spodoptera Sf9 cells suggests a similar cellular mechanism of action for azadirachtin
AJ Mordue, AJ Nisbet, L Jennens, SV Ley, W Mordue
AZADIRACHTA INDICA A. JUSS.
(1999)
Local interpretation of chaotic dynamics in a many-body classical hamiltonian system
DJ Wales, RS Berry
Journal of Physics B Atomic Molecular and Optical Physics
(1999)
24
Calculation of integral cross sections for vibrationally inelastic electron-methane scattering
SC Althorpe, FA Gianturco, N Sanna
Journal of Physics B: Atomic, Molecular and Optical Physics
(1999)
28
Supramolecular catalysis in transition
JKM Sanders
SUPRAMOLECULAR SCIENCE: WHERE IT IS AND WHERE IT IS GOING
(1999)
527
The chemical bond in molecules and solids
RM Lynden-Bell
CRYSTAL ENGINEERING: THE DESIGN AND APPLICATION OF FUNCTIONAL SOLIDS
(1999)
539
The second dielectric virial coefficient of the dipolar Gay-Berne fluid
AD Buckingham, Y Tantirungrotechai
Canadian Journal of Chemistry
(1999)
77
Analysis of protein–protein interactions by mutagenesis: direct versus indirect effects
DE Otzen, AR Fersht
Protein Engineering Design and Selection
(1999)
12
NMR studies of molecular recognition by metalloporphyrins
N Bampos, Z Clyde-Watson, JC Hawley, CC Mak, A Vidal-Ferran, SJ Webb, JKM Sanders
NMR IN SUPRAMOLECULAR CHEMISTRY
(1999)
526
The effect of the range of the potential on the structure and stability of simple liquids: From clusters to bulk, from sodium to C60
JPK Doye, DJ Wales
Journal of Physics B Atomic Molecular and Optical Physics
(1999)
29
Comparativeab initiopseudopotential studies of group V overlayers on Si(001)
SCA Gay, SJ Jenkins, GP Srivastava
Journal of Physics Condensed Matter
(1999)
10
Low-frequency vibrational excitations in vitreous silica: The Ioffe-Regel limit
SN Taraskin, SR Elliott
Journal of Physics Condensed Matter
(1999)
11
THE STRUCTURE OF NOVEL METALLO-PORPHYRINS DETERMINED USING SYNCHROTRON X-RAY RADIATION
N Feeder, PR Raithby, JKM Sanders, SL Darling
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES
(1999)
55
Influence of capillary confinement on the equilibrium shape of vesicles
K Helal, T Biben, J-P Hansen
Journal of Physics: Condensed Matter
(1999)
11
GENETIC ALGORITHMS FOR MOLECULAR RECOGNITION
G Jones, RC Glen, AR Leach, R Taylor, P Willet
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES
(1999)
55
ADC ESTERS, AUTOCLEAVAGE AND CATALYSIS: WHAT THE STRUCTURES SAY.
F von Delft, A Albert, V Dhanaraj, U Genschel, MK Rajmee, M Witty, R Pulido, TL Blundell, AG Smith, C Abell
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES
(1999)
55
Orientationally disordered solids
RM Lynden-Bell
CRYSTAL ENGINEERING: THE DESIGN AND APPLICATION OF FUNCTIONAL SOLIDS
(1999)
539
A molecular dynamics study of orientational disordering in crystalline sodium nitrate
RM Lynden-Bell, M Ferrario, IR McDonald, E Salje
Journal of Physics Condensed Matter
(1999)
1