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  • Currently displaying 23201 - 23220 of 31827 publications
Author(s)
Publication title
Journal Name
Publication year
The dynamics of conformational isomerization in flexible biomolecules. II. Simulating isomerizations in a supersonic free jet with master equation dynamics
DA Evans, DJ Wales, BC Dian, TS Zwier
Journal of Chemical Physics
(2004)
120
Conformational dynamics of OmpA: MD simulations of a bacterial outer membrane protein
PJ Bond, MSP Sansom
BIOPHYSICAL JOURNAL
(2004)
86
TETRATIC PHASE IN THE PLANAR HARD SQUARE SYSTEM?
KW WOJCIECHOWSKI, D FRENKEL
Computational Methods in Science and Technology
(2004)
10
Magnetism and structural chemistry of the n=2 Ruddlesden-Popper phase La3LiMnO7
PD Battle, JC Burley, DJ Gallon, CP Grey, J Sloan
Journal of Solid State Chemistry
(2004)
177
Molecular Surface Point Environments for Virtual Screening and the Elucidation of Binding Patterns (MOLPRINT)
A Bender, HY Mussa, GS Gill, RC Glen
2004 IEEE INTERNATIONAL CONFERENCE ON SYSTEMS, MAN & CYBERNETICS, VOLS 1-7
(2004)
5
Cubatic phase for tetrapods
R Blaak, BM Mulder, D Frenkel
(2004)
HIGH-RESOLUTION ELECTRON-MICROSCOPY OF THE HIGH-TC SUPERCONDUCTOR BI2+XSR2CA1-XCU2O8+SIGMA
W Zhou, AI Kirkland, KD Mackay, AR Armstrong, MR Harrison, DA Jefferson, WY Liang, PP Edwards
Angewandte Chemie - International Edition in English
(2003)
28
A Joint Structural Characterization of Colloidal Platinum by EXAFS and High‐Resolution Electron Microscopy
DG Duff, PP Edwards, J Evans, JT Gauntlett, DA Jefferson, BFG Johnson, AI Kirkland, DJ Smith
Angewandte Chemie International Edition
(2003)
28
Molecular similarity searching using atom environments, information-based feature selection, and a naive Bayesian classifier
A Bender, HY Mussa, RC Glen, S Reiling
Journal of Chemical Information and Computer Sciences
(2003)
44
Hypothetical Uninodal Zeolite Structures: Comparison of AlPO4 and SiO2 Compositions Using Computer Simulation
A Simperler, MD Foster, RG Bell, J Klinowski
Journal of Physical Chemistry B
(2003)
108
Crystal Structure of a Supramolecular Dimer Formed by ππ Interactions between Two Interlocked Cyclic Zinc Porphyrin Trimers
HL Anderson, A Bashall, K Henrick, M McPartlin, JKM Sanders
Angewandte Chemie International Edition
(2003)
33
Nucleophilic Substitution of Bis(cyclopentadienyl)‐tin(II); Synthesis, Structure, and Solution Dynamics of trans‐[(η3‐Cp)Sn{μ2‐NC(NMe2)2}]2
MA Paver, DS Wright, D Stalke
Angewandte Chemie International Edition
(2003)
32
[(η5‐Cp)2Sn(μ‐η5‐Cp)Na · PMDETA], a Compound with a Trigonal‐Planar “Paddle Wheel” Triorganostannate Ion
MG Davidson, D Stalke, DS Wright
Angewandte Chemie International Edition in English
(2003)
31
CYCLOHEXANE-1,2-DIACETALS IN SYNTHESIS .1. CYCLOHEXANE-1,2-DIACETALS (CDA) - A NEW PROTECTING GROUP FOR VICINAL DIOLS IN CARBOHYDRATES
SV Ley, HWM Priepke, SL Warrine
Angewandte Chemie International Edition
(2003)
33
A Facile One‐Pot Synthesis of a Trisaccharide Unit from the Common Polysaccharide Antigen of Group B Streptococci Using Cyclohexane‐1, 2‐diacetal (CDA) Protected Rhamnosides
SV Ley, HWM Priepke
Angewandte Chemie International Edition in English
(2003)
33
Self‐Assembly of a Dimeric Porphyrin Host
CA Hunter, LD Sarson
Angewandte Chemie International Edition
(2003)
33
Supramolecular Activation of Para-Benzoquinone
PA Brooksby, AJ McQuillan, DH Purvis, AE Rowan, R Walsh, CA Hunter, RJ Shannon
Angewandte Chemie International Edition
(2003)
33
Free‐Energy Profile for a Host‐Accelerated Diels–Alder Reaction: The Sources of exo Selectivity
CJ Walter, JKM Sanders
Angewandte Chemie International Edition in English
(2003)
34
Scavenger Templates: Synthesis and Electrospray Mass Spectrometry of a Linear Porphyrin Octamer
S Anderson, HL Anderson, JKM Sanders
Angewandte Chemie International Edition
(2003)
31
VITAMIN-B12 - HOW THE PROBLEM OF ITS BIOSYNTHESIS WAS SOLVED
F Blanche, B Cameron, J Crouzet, L Debussche, D Thibaut, M Vuilhorgne, FJ Leeper, AR Battersby
Angewandte Chemie International Edition in English
(2003)
34