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- Currently displaying 22661 - 22680 of 29607 publications
What can classical simulators learn from ab initio simulations?
Journal of Molecular Liquids
(2002)
98-99
79
The superstructure of lead tetragonal tungsten bronze
Journal of Solid State Chemistry
(2002)
168
306
(doi: 10.1006/jssc.2002.9630)
New Directions: Mobile laboratory reveals new issues in urban air quality
Atmospheric Environment
(2002)
36
1247
Diode Laser Spectrum of the ν1 Fundamental Band of PNO
Journal of Molecular Spectroscopy
(2002)
211
107
(doi: 10.1006/jmsp.2001.8487)
OmpA: A pore or not a pore? Simulation and modeling studies
Biophys J
(2002)
83
763
Ag-catalysed epoxidation of propene and ethene:: an investigation using electrochemical promotion of the effects of alkali, NOx, and chlorine
Journal of Catalysis
(2002)
207
331
(doi: 10.1006/jcat.2002.3509)
Self-assembly of porphyrin arrays
Advances in Inorganic Chemistry, Vol 53
(2002)
53
213
Diatomics-in-Molecules Potentials Incorporating ab initio\/ Data: Application to Ionic, Rydberg-Excited, and Molecule-Doped Rare Gas Clusters
Compu. Phys. Comm.
(2002)
145
141-155
Coverage dependence of the dissociative sticking probability of methane on Pt(1 1 0)-(1 × 2)
Surface Science
(2002)
506
243
Biophysical studies of the development of amyloid fibrils from a peptide fragment of cold shock protein B.
Eur J Biochem
(2001)
267
2609
Preparation of recombinant tissue inhibitor of metalloproteinasesā1 (TIMPā1) in high yield and identification of a hydrophobic surface feature
European journal of biochemistry
(2001)
257
562
Boron-mediated aldol reactions of ethyl alpha-(N,N)-dibenzylamino ketones: control of enolisation geometry and aldehyde pi-facial selectivity
Tetrahedron Letters
(2001)
42
9269
Zirconocene-mediated, high-yielding macrocyclizations of silyl-terminated diynes
Chemistry (Weinheim an der Bergstrasse, Germany)
(2001)
8
74
Facile H-D exchange in adsorbed methylidyne on Pt(110)-(1×2) and deuteration to gaseous methane
The Journal of Chemical Physics
(2001)
115
11306
(doi: 10.1063/1.1410387)
Characterization of the Co(2+) and Ni(2+) binding amino-acid residues of the N-terminus of human albumin. An insight into the mechanism of a new assay for myocardial ischemia.
European journal of biochemistry
(2001)
268
42
A further clue to understanding the mobility of mitochondrial yeast cytochrome c: a (15)N T1rho investigation of the oxidized and reduced species.
European journal of biochemistry
(2001)
268
4468
Torsional effects on reactivity in glycosyl transfer
Journal of the Chemical Society, Perkin Transactions 2
(2001)
337
(doi: 10.1039/b106257n)
Modification of the solid-state structure of bis(1-hydroxy-2(1H)-pyridinethiolato-S2,O)zinc(II): Synthesis and characterisation of a molecular solid solution incorporating 3-hydroxy-4-methyl-2(3H)-thiazolethione
Journal of Materials Chemistry
(2001)
12
324
(doi: 10.1039/b106734f)