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  • Currently displaying 21241 - 21260 of 31156 publications
Author(s)
Publication title
Journal Name
Publication year
Density Functional Theory Study of Tetrathiafulvalene and Thianthrene in Acetonitrile: Structure, Dynamics, and Redox Properties †
J VandeVondele, R Lynden-Bell, EJ Meijer, M Sprik
The Journal of Physical Chemistry B
(2005)
110
On the correlation between bond-length change and vibrational frequency shift in hydrogen-bonded complexes: A computational study of Y center dot center dot center dot HCl dimers (Y = N-2, CO, BF)
SAC McDowell, AD Buckingham
J AM CHEM SOC
(2005)
127
Simulating rare events in equilibrium or non-equilibrium stochastic systems
RJ Allen, D Frenkel, PRT Wolde
(2005)
Quantum Delocalization of Hydrogen in the Li2NH Crystal
C Zhang, M Dyer, A Alavi
The Journal of Physical Chemistry B
(2005)
109
Hydrothermal synthesis, structural characterisation and magnetic behaviour of hybrid complexes of N-(phosphonomethyl)iminodiacetate
F-N Shi, FAA Paz, PI Girginova, L Mafra, VS Amaral, J Rocha, A Makal, K Wozniak, J Klinowski, T Trindade
Journal of Molecular Structure
(2005)
754
Catalyst patterning methods for surface-bound chemical vapor deposition of carbon nanotubes
S Hofmann, M Cantoro, M Kaempgen, DJ Kang, VB Golovko, HW Li, Z Yang, J Geng, WTS Huck, BFG Johnson, S Roth, J Robertson
Applied Physics A Materials Science and Processing
(2005)
81
The Structure of the Chiral Pt{531} Surface:  A Combined LEED and DFT Study
SR Puisto, G Held, V Ranea, SJ Jenkins, EE Mola, DA King
J Phys Chem B
(2005)
109
DNA Molecular Motor Driven Micromechanical Cantilever Arrays
W Shu, D Liu, M Watari, CK Riener, T Strunz, ME Welland, S Balasubramanian, RA McKendry
J Am Chem Soc
(2005)
127
Mononuclear and Polynuclear Chain Complexes of a Series of Multinucleating N/S Donor Ligands
TK Ronson, H Adams, MD Ward
European Journal of Inorganic Chemistry
(2005)
2005
Synthesis of 5-aza-analogues of angucyclines: Manipulation of the 2-deoxy-C-glycoside subunit
NQ Vu, G Dujardin, SC Collet, EA Raiber, AY Guingant, M Evain
Tetrahedron Letters
(2005)
46
Controlled formation and topologies of thiophenolate-based macrocycles: rings, cylinders and bowls
A Christensen, C Mayer, F Jensen, AD Bond, CJ McKenzie
Dalton Transactions
(2005)
6
Semipermanent p-nitrobenzyloxycarbonyl (pNZ) protection of Orn and Lys side chains: prevention of undesired α-Fmoc removal and application to the synthesis of cyclic peptides
A Isidro-Llobet, M Álvarez, F Albericio
Tetrahedron Letters
(2005)
46
Use of p-nitrobenzyloxycarbonyl (pNZ) as a permanent protecting group in the synthesis of Kahalalide F analogs
PE López, A Isidro-Llobet, C Gracia, LJ Cruz, A García-Granados, A Parra, M Álvarez, F Albericio
Tetrahedron Letters
(2005)
46
Switching the Properties of Polyelectrolyte Brushes via “Hydrophobic Collapse”
O Azzaroni, S Moya, T Farhan, AA Brown, WTS Huck
Macromolecules
(2005)
38
Anionic phospholipid interactions with the potassium channel KcsA: simulation studies
SS Deol, C Domene, PJ Bond, MSP Sansom
Biophysical Journal
(2005)
90
Three-stage switching of surface wetting using phosphate-bearing polymer brushes
F Zhou, WTS Huck
Chem Commun (Camb)
(2005)
Four base recognition by triplex-forming oligonucleotides at physiological pH
DA Rusling, VEC Powers, RT Ranasinghe, Y Wang, SD Osborne, T Brown, KR Fox
Nucleic Acids Research
(2005)
33
Intermolecular forces and clusters: Contributions in honour of anthony stone
DJ Wales
Structure and Bonding
(2005)
116
A Template-Controlled Solid-State Reaction for the Organic Chemistry Laboratory
T Friscic, TD Hamilton, GS Papaefstathiou, LR MacGillivray
Journal of Chemical Education
(2005)
82
Solvothermal synthesis of new metal organic framework structures in the zinc–terephthalic acid–dimethyl formamide system
HF Clausen, RD Poulsen, AD Bond, M-AS Chevallier, BB Iversen
Journal of Solid State Chemistry
(2005)
178