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  • Currently displaying 15561 - 15580 of 29893 publications
Author(s)
Publication title
Journal Name
Publication year
Confinement of halide ions within homologous inverse coordination hosts; modification of halide -ion selectivity
F García, RJ Less, M McPartlin, A Michalski, RE Mulvey, V Naseri, ML Stead, A Morán de Vega, DS Wright
Chem Commun (Camb)
(2010)
47
Kinetics of chain motions within a protein-folding intermediate.
H Neuweiler, W Banachewicz, AR Fersht
Proceedings of the National Academy of Sciences
(2010)
107
A high-throughput fluorescence chemical denaturation assay as a general screen for protein–ligand binding
K Mahendrarajah, PA Dalby, B Wilkinson, SE Jackson, ERG Main
Analytical Biochemistry
(2010)
411
Pertubation theory for systems with strong short-ranged interactions
P SillrÉn, J-P Hansen
Molecular Physics
(2010)
105
A Special Issue in Honour of Professor Jean-Jacques Weis INTRODUCTION
J-P Hansen
Molecular Physics
(2010)
107
Structure and pair correlations of a simple coarse grained model for supercritical carbon dioxide
BM Mognetti, M Oettel, P Virnau, L Yelash, K Binder
Molecular Physics
(2010)
107
Crystal stability of diblock copolymer micelles in solution
JJ Molina, C Pierleoni, B Capone, J-P Hansen, ISS de Oliveira
Molecular Physics
(2010)
107
Nuclear magnetic shielding surfaces for CH3 F, CH3 Cl, and CH3 Br
BADBARM OLEGARIO
Molecular Physics
(2010)
92
Efficient schemes to compute diffusive barrier crossing rates
MJ RUIZ-MONTERO, D FRENKEL, JJ BREY
Molecular Physics
(2010)
90
Solar hydrogen evolution with hydrogenases: From natural to hybrid systems
E Reisner
European Journal of Inorganic Chemistry
(2010)
2011
A density functional water dimer potential surface
BDKW MOK, NCHARD AMOS
Molecular Physics
(2010)
92
An ab initio study of anharmonicity and matrix effects on the hydrogen-bonded BrH:NH complex 3
BJE DEL BENE MEREDITH J. T. JORDAN, PMWGAAD BUCKINGHAM
Molecular Physics
(2010)
92
The derivation of vibration-rotation kinetic energy operators in internal coordinates. II
SM COLWELL, NC HANDY
Molecular Physics
(2010)
92
Phase behavior of heptanamide adsorbed on a graphite substrate.
T Bhinde, TK Phillips, SM Clarke, T Arnold, JE Parker
Langmuir
(2010)
27
Structure, rearrangements and evaporation of rotating atomic clusters
MA MILLER, DJ WALES
Molecular Physics
(2010)
89
A study of sulphur-containing molecules using Hartree-Fock, MP2 and DFT (hybrid) methodologies
BJA ALTMANN, NCHAVE INGAMELLS
Molecular Physics
(2010)
92
Structure and properties of Ne n +; clusters from a diatomics-in-molecules approach
FY NAUMKIN, DJ WALES
Molecular Physics
(2010)
93
Self-Assembly of Lamellar Microphases in Linear Gradient Copolymer Melts
NB Tito, ST Milner, JEG Lipson
Macromolecules
(2010)
43
Transferability of topologically partitioned polarizabilities: the case of n-alkanes
AJ STONE, C HÄTTIG, G JANSEN, JG ÀNGYÀ
Molecular Physics
(2010)
89
Atomistic simulation of the stretching of nanoscale metal wires
BGM FINBOW, RML-BAIR MCDONALD
Molecular Physics
(2010)
92