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- Currently displaying 25001 - 25020 of 29614 publications
Fluctuation, relaxation and rearrangement dynamics of a model (H2O)(20) cluster: Non-statistical dynamical behavior
The Journal of Chemical Physics
(1997)
106
3329
(doi: 10.1063/1.473081)
Preparation, structure, derivatisation and NMR data of cyclohexane-1,2-diacetal protected carbohydrates
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1
(1997)
351
(doi: 10.1039/a605851e)
Synthesis and characterisation of [M 2 (η 5 -C 5 H 5 ) 2 ( CO) 4 (µ-PH 2 )(µ-H)] (M = Mo, W); a new route to µ-PH 2 complexes involving novel activation of a bridging diphosphorus ligand
Chemical Communications
(1997)
361
(doi: 10.1039/a608219j)
Higher-order gradient corrections for exchange-correlation functionals
Chemical Physics Letters
(1997)
266
16
Adsorption of Ethyne on Cu(110): Experimental and Theoretical Study
Langmuir
(1997)
13
758
(doi: 10.1021/la960865j)
The use of a dithiane protected benzoin photolabile safety catch linker for solid-phase synthesis.
Tetrahedron Letters
(1997)
38
1227
Cyclobutanone as an electrophile for lithiated phosphine oxides: ‘Internal quench’ conditions
Journal of Organometallic Chemistry
(1997)
529
279
Experimental and molecular orbital calculational study of the stereoselective Horner-Wittig reaction with phosphine oxides: Control of stereoselectivity by lithium
Journal of Organometallic Chemistry
(1997)
529
29
Modified configurational bias Monte Carlo method for simulation of polymer systems
The Journal of Chemical Physics
(1997)
106
2970
(doi: 10.1063/1.473356)
Distribution of tetrahedral and octahedral A1 sites in gamma alumina
Chemical Physics Letters
(1997)
265
673
On the accuracy of molecular exchange-correlation potentials computed from electron densities
Chemical Physics Letters
(1997)
265
614
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SCIENCE
(1997)
275
912
Gradient Line Reaction Paths for Hindered Internal Rotation in H2BNH2 and Inversion in PF3
Journal of Physical Chemistry A
(1997)
101
1384
(doi: 10.1021/jp9628343)
An approach to the manzamine alkaloids modelled on a biogenetic theory
Tetrahedron
(1997)
53
2271
A spectroscopic study of the chemistry and reactivity of SO2 on Pt{111}: Reactions with O2, CO and C3H6
Surface Science
(1997)
372
279
DNA base-stacking interactions: a comparison of theoretical calculations with oligonucleotide X-ray crystal structures
Journal of Molecular Biology
(1997)
265
603
(doi: 10.1006/jmbi.1996.0755)
Organic Molecular Solids
(1997)
Reactivity and Crystal Design in Organic Solid State Chemistry
(1997)
6
The folding pathway of a protein at high resolution from microseconds to seconds.
Proceedings of the National Academy of Sciences
(1997)
94
826
(doi: 10.1073/pnas.94.3.826)