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- Currently displaying 28921 - 28940 of 30835 publications
ARTIFACTS IN THE APPLICATION OF LINEAR FREE-ENERGY ANALYSIS
PROTEIN ENG
(1987)
1
442
(doi: 10.1093/protein/1.6.442)
A molecular dynamics study of the rotator phase of t-butyl bromide
Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics
(1987)
83
2097
(doi: 10.1039/F29878302097)
SYNTHESIS, CHEMISTRY, ELECTRONIC PROPERTIES, AND MAGNETISM IN THE Y-Ba-Cu-O SUPERCONDUCTOR SYSTEMS. .
ACS Symposium Series
(1987)
a-1-a-17
Infrared chemiluminescence studies using a SISAM spectrometer. Reactions producing vibrationally excited OH
Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics
(1987)
83
229
(doi: 10.1039/f29878300229)
Closed-shell structures and the building game
Chemical Physics Letters
(1987)
141
478
(doi: 10.1016/0009-2614(87)85064-9)
Tests of photochemical and dynamical theories from satellite data
Philosophical Transactions Royal Society of London A
(1987)
323
667
(doi: 10.1098/rsta.1987.0113)
The analytic configuration interaction gradient method: The calculation of one electron properties
The Journal of Chemical Physics
(1987)
87
5976
(doi: 10.1063/1.453521)
PHOTOINDUCED CHANGES OF AC TRANSPORT IN AMORPHOUS AS2S3 FILMS
Phys Rev B Condens Matter
(1987)
36
7741
(doi: 10.1103/physrevb.36.7741)
Optimization of a distributed Gaussian basis set using simulated annealing: Application to the solvated electron
The Journal of Chemical Physics
(1987)
87
5987
(doi: 10.1063/1.453522)
The preparation and X -ray structure of naphthalenedithiadiphosphetanedisulphide
Chemical Communications
(1987)
1741
(doi: 10.1039/C39870001741)
The structure and vibrational frequencies of the ArH3+ ion and its isotopomers
Chemical Physics Letters
(1987)
141
166
(doi: 10.1016/0009-2614(87)85003-0)
Prediction of electrostatic effects of engineering of protein charges.
Nature
(1987)
330
86
(doi: 10.1038/330086a0)
Magic-angle-spinning NMR shows the aluminosilicate framework of ultramarine to be disordered
Nature
(1987)
330
56
(doi: 10.1038/330056a0)
THE IMPACT OF SUPERCOMPUTERS ON CHEMISTRY - INTERNATIONAL-CONFERENCE HELD AT UNIVERSITY-OF-LONDON, APRIL, 1987
THEOR CHIM ACTA
(1987)
72
233
Combining transition state theory with quasiclassical trajectory calculations. III. Applications to the three-dimensional H + H2(ν) reaction
Chemical Physics
(1987)
117
421
(doi: 10.1016/0301-0104(87)80193-3)
Soft-sphere model for the glass transition in binary alloys: Pair structure and self-diffusion
Phys Rev A Gen Phys
(1987)
36
4891
(doi: 10.1103/physreva.36.4891)
EFFECTIVE MOLARITIES FOR INTRAMOLECULAR HYDRIDE TRANSFER - REDUCTION BY 1,4-DIHYDROPYRIDINES OF THE NEIGHBORING ALPHA-KETOESTER GROUP
GAZZETTA CHIMICA ITALIANA
(1987)
117
667
Preparation and use of tetra-n-butylammonium per-ruthenate (TBAP reagent) and tetra-n-propylammonium per-ruthenate (TPAP reagent) as new catalytic oxidants for alcohols
Journal of the Chemical Society, Chemical Communications
(1987)
1625
(doi: 10.1039/C39870001625)
COMBINING TRANSITION-STATE THEORY WITH QUASI-CLASSICAL TRAJECTORY CALCULATIONS - APPLICATION TO THE NITROGEN EXCHANGE-REACTION N+N2(NU) .4.
Chemical Physics Letters
(1987)
140
499
(doi: 10.1016/0009-2614(87)80476-1)
A theoretical determination of the rovibrational energy levels of the water molecule
The Journal of Chemical Physics
(1987)
87
4294
(doi: 10.1063/1.452887)
