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- Currently displaying 28021 - 28040 of 30617 publications
BASIC CONCEPTS AND TOOLS OF LIQUID-STATE THEORY
HYDROGEN-BONDED LIQUIDS
(1991)
329
5
Vapour-liquid equilibria of the hard core yukawa fluid
Molecular Physics
(1991)
74
35
(doi: 10.1080/00268979100102031)
Terpenoid biosynthesis and the stereochemistry of enzyme-catalysed allylic addition-elimination reactions
(1991)
332
123
Novel scheme to compute chemical potentials of chain molecules on a lattice
Molecular Physics
(1991)
74
41
(doi: 10.1080/00268979100102041)
AN INTRODUCTION TO MOLECULAR-DYNAMICS, WITH APPLICATIONS TO THE GLASS-TRANSITION
COMPUTER SIMULATION IN MATERIALS SCIENCE
(1991)
205
3
PLASMA SIMULATIONS USING THE CAR-PARRINELLO METHOD
COMPUTER SIMULATION IN MATERIALS SCIENCE
(1991)
205
467
THEORETICAL-STUDY OF SOME SMALL VANDERWAALS COMPLEXES CONTAINING INERT-GAS ATOMS
\molphys
(1991)
74
1-25
rearrangements in polyhedral boranes and metal clusters
electron deficient boron and carbon clusters
(1991)
143
The aldol reaction for transition metal enolates
(1991)
2
301
"Characterisation of Unfolded and Partially Folded States of Proteins by NMR Spectroscopy", in Conformations and Forces in Protein Folding
(1991)
175
On the anisotropy of diffusion in nematic liquid crystals: test of a modified affine transformation model via molecular dynamics
Molecular Physics
(1991)
74
765
(doi: 10.1080/00268979100102561)
Research note:Diode laser infrared spectroscopy of jet-cooled hexacarbonyls of chromium, molybdenum, and tungsten
Molecular Physics
(1991)
74
919
(doi: 10.1080/00268979100102691)
THE CALCULATION OF INTERMOLECULAR POTENTIALS
ADVANCES IN BIOMOLECULAR SIMULATIONS
(1991)
239
3
SKELETAL REARRANGEMENTS IN CLUSTERS - SOME NEW THEORETICAL INSIGHTS INVOLVING LIPSCOMB DIAMOND-SQUARE-DIAMOND MECHANISM
ELECTRON DEFICIENT BORON AND CARBON CLUSTERS
(1991)
143
Ionic transport in glassy materials
Radiation Effects and Defects in Solids
(1991)
119-121
3
(doi: 10.1080/10420159108224845)
METHODS FOR CALCULATING INTERMOLECULAR POTENTIAL-ENERGY SURFACES
HYDROGEN-BONDED LIQUIDS
(1991)
329
25
PACKING SCHEMES FOR LENNARD-JONES CLUSTERS OF 13 TO 150 ATOMS - MINIMA, TRANSITION-STATES AND REARRANGEMENT MECHANISMS
\jcsft
(1991)
87
215-222
Theoretical study of some small van der Waals complexes containing inert gas atoms
Molecular Physics
(1991)
74
1
(doi: 10.1080/00268979100102011)
Investigation of porphyrins and metalloporphyrins by fast atom bombardment mass spectrometry
Analytica Chimica Acta
(1990)
241
281
Strength and co-operativity of contributions of surface salt bridges to protein stability.
J Mol Biol
(1990)
216
1031
