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  • Currently displaying 25521 - 25540 of 29657 publications
Author(s)
Publication title
Journal Name
Publication year
Introduction to molecular dynamics methods
M Sprik
MONTE CARLO AND MOLECULAR DYNAMICS OF CONDENSED MATTER SYSTEMS
(1996)
49
Can enzyme mimics compete with catalytic antibodies?
CJ Walter, LG Mackay, JKM Sanders
CHEMICAL SYNTHESIS
(1996)
320
Rapid intramolecular and C-O cleavage reactions of a phosphate triester catalysed by a neighbouring hydroxyl group
AJ Kirby, RE Marriott
RECUEIL DES TRAVAUX CHIMIQUES DES PAYS-BAS-JOURNAL OF THE ROYAL NETHERLANDS CHEMICAL SOCIETY
(1996)
115
Extraction of nitric oxide and nitrogen dioxide from an oxygen carrier using molecular sieve 5A
BB Poulton, L Foubert, J Klinowski, RD Latimer, PR Knowles, A Vuylsteke
Br J Anaesth
(1996)
77
Quenched disorder, memory, and self-organization
M Marsili, G Caldarelli, M Vendruscolo
Physical Review E Statistical Physics Plasmas Fluids and Related Interdisciplinary Topics
(1996)
53
Self-assembly of macrocyclic porphyrin oligomers (pg 2567, 1995)
XL Chi, AJ Guerin, RA Haycock, CA Hunter, LD Sarson
CHEMICAL COMMUNICATIONS
(1996)
Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water
M Tuckerman, M Sprik, M Parrinello
FEMTOCHEMISTRY
(1996)
A systematic optimization scheme for configurational bias Monte Carlo
GCAM Mooij, D Frenkel
Molecular Simulation
(1996)
17
Kinetics at Ultra-Low Temperatures: Non-Arrhenius Behaviour and Applications to the Chemistry of Interstellar Clouds
IWM Smith, BR Rowe, IR Sims
(1996)
61
Liquid-like behavior in solids
D Frenkel, P Bladon, P Bolhuis, M Hagen
Molecular Simulation
(1996)
16
"Insights into Protein Dynamics using NMR Techniques", in Dynamics and the Problem of Recognition in Biological Macromolecules
LJ Smith, CM Dobson
(1996)
THE STRUCTURE AND STABILITY OF ATOMIC LIQUIDS - FROM CLUSTERS TO BULK
JPK Doye, DJ Wales
Science
(1996)
271
Projected temperature increases over southern Africa due to increasing levels of greenhouse gases and sulphate aerosols
AM Joubert, MO Köhler
S. Afr. J. Sci.
(1996)
92
ON POTENTIAL-ENERGY SURFACES AND RELAXATION TO THE GLOBAL MINIMUM
JPK Doye, DJ Wales
J. Chem. Phys.
(1996)
105
THE STRUCTURE OF $(C_60)_N$ CLUSTERS
JPK Doye, DJ Wales
Chem. Phys. Lett.
(1996)
262
THE EFFECT OF THE RANGE OF THE POTENTIAL ON THE STRUCTURE AND STABILITY OF SIMPLE LIQUIDS - FROM CLUSTERS TO BULK, FROM SODIUM TO C-60
JPK Doye, DJ Wales
J. Phys. B
(1996)
29
Nonlinear Raman spectroscopy of liquid crystals: orientational alignment and switching behaviour in a ferroelectric liquid crystal mixture
WJ JONES, R ALLOTT, J BARAN, A GROFCSIK, M KUBINYI, M STANLEY
Molecular Physics
(1996)
88
Infrared laser spectrum of the Si2- anion in a silane plasma
Z Liu, PB Davies
Physical Review Letters
(1996)
76
Investigation of protein folding by mass spectrometry.
A Miranker, CV Robinson, SE Radford, CM Dobson
FASEB journal : official publication of the Federation of American Societies for Experimental Biology
(1996)
10
Density functional methods at finite temperature
JP Hansen, E Smargiassi
MONTE CARLO AND MOLECULAR DYNAMICS OF CONDENSED MATTER SYSTEMS
(1996)
49