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  • Currently displaying 19581 - 19600 of 29659 publications
Author(s)
Publication title
Journal Name
Publication year
Virtual screening: The king (quite often) has no clothes
RC Glen, A Bender
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Dinuclear Iron Centers for dioxygen activation and selective oxidation chemistry
SJ Lippard, JJ Kodanko, A Morys, M Zhao, E Reisner, S Friedle
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Comparative NAMFIS analysis of Geldanamycin and Radidicol
P Thepchatri, DO Cicero, T Eliseo, DC Myles, JP Snyder
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Applications of a highly enantioselective sulfur-ylide in epoxidation reactions
CP Tubb, JM Goodman
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Adsorption of atmospherically relevant gases and PAHs at the air/water interface
R Vacha, M Mucha, BJ Finlayson-Pitts, P Jungwirth
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Polyzwitterionic brushes: Switching based on self-association
WTS Huck, A Brown, O Azzaroni
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Polymer brushes for soft nanotechnology
WTS Huck
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Preparation of supermolecular polymers with complementary hydrogen bonding motifs
E van der Aa, OA Scherman, EW Meijer
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Molecular simulations of membrane proteins: Protein/membrane interactions
M Sansom, PJ Bond, S Khalid, K Balali-Mood
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Computational chemistry in XML
P Murray-Rust, HS Rzepa, JA Townsend, D Wilson
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2006)
231
Lattice-Boltzmann simulation of the sedimentation of charged disks.
F Capuani, I Pagonabarraga, D Frenkel
Journal of Chemical Physics
(2006)
124
A flow process for the multi-step synthesis of the alkaloid natural product oxomaritidine: a new paradigm for molecular assembly.
IR Baxendale, J Deeley, CM Griffiths-Jones, SV Ley, S Saaby, GK Tranmer
Chemical Communications
(2006)
Choices of Iron and Copper: Cooperative Selection during Self‐Assembly
D Schultz, JR Nitschke
Angewandte Chemie
(2006)
118
Choices of iron and copper: Cooperative selection during self-assembly
D Schultz, JR Nitschke
Angewandte Chemie (International ed. in English)
(2006)
45
A first-principles investigation of LiNH(2) as a hydrogen-storage material: effects of substitutions of K and Mg for Li.
C Zhang, A Alavi
J Phys Chem B
(2006)
110
Lattice-Boltzmann simulations of ionic current modulation by DNA translocation
S Reboux, F Capuani, D Frenkel
Journal of Chemical Theory and Computation
(2006)
2
The Folding Pathway of Spectrin R17 from Experiment and Simulation: Using Experimentally Validated MD Simulations to Characterize States Hinted at by Experiment
KA Scott, LG Randles, SJ Moran, V Daggett, J Clarke
Journal of Molecular Biology
(2006)
359
Rotational reorientation dynamics of ionic dye solutes in polar solvents with the application of a general model for the solvation shell
M Kubinyi, A Grofcsik, T Kárpáti, WJ Jones
Chemical Physics
(2006)
322
Crystal gazing
FA Paz, J Klinowski
Chemistry and Industry London
(2006)
Modelling molecular iodine emissions in a coastal marine environment: the link to new particle formation
A Saiz-Lopez, JMC Plane, G McFiggans, PI Williams, SM Ball, M Bitter, RL Jones, C Hongwei, T Hoffmann
Atmospheric Chemistry and Physics
(2006)
6