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- Currently displaying 21501 - 21520 of 30393 publications
Phi-Value analysis and the nature of protein-folding transition states
Proceedings of the National Academy of Sciences of the United States of America
(2004)
101
7976
(doi: 10.1073/pnas.0402684101)
Growth of aligned carbon nanofibres over large areas using colloidal catalysts at low temperatures
Chemical communications (Cambridge, England)
(2004)
4
1416
(doi: 10.1039/b401785d)
Femtosecond Pump/Probe Spectroscopy of CO on Ru{101̄0} from Experimental and Theoretical Perspectives †
The Journal of Physical Chemistry B
(2004)
108
14311
(doi: 10.1021/jp049679+)
Poisson-Boltzmann Brownian dynamics of charged colloids in suspension
Computer Physics Communications
(2004)
159
73
(doi: 10.1016/j.cpc.2003.10.001)
Supercooled Lennard-Jones liquids and glasses: a kinetic Monte Carlo approach
Journal of Non Crystalline Solids
(2004)
336
218
Surface modification of fluorinated aluminas: Application of solid state NMR spectroscopy to the study of acidity and surface structure
Journal of Catalysis
(2004)
224
69
(doi: 10.1016/j.jcat.2004.02.013)
Effect of metastable liquid - Liquid demixing on the morphology of nucleated polymer crystals
Macromolecules
(2004)
37
4336
(doi: 10.1021/ma049581t)
NMR studies of molecular dynamics
FASEB JOURNAL
(2004)
18
C121
Complete functionalisation of small and large diameter bromopolystyrene beads; applications for solid-supported reagents, scavengers and diversity-oriented synthesis
Organic & Biomolecular Chemistry
(2004)
2
1679
(doi: 10.1039/b406488g)
2H MAS NMR Studies of Deuterated Goethite (α-FeOOD)
Journal of Physical Chemistry B
(2004)
108
{6938-6940}
(doi: 10.1021/jp0486090)
Solution-processible conjugated electrophosphorescent polymers.
Journal of the American Chemical Society
(2004)
126
7041
(doi: 10.1021/ja039445o)
Ab Initio Molecular Dynamics Study of Uracil in Aqueous Solution
Journal of Physical Chemistry B
(2004)
108
7458
(doi: 10.1021/jp049940m)
Is an intermediate state populated on the folding pathway of ubiquitin?
FEBS Lett
(2004)
567
333
Electron correlation in a hard spherical external potential: Wigner molecule formation and hybridization - art. no. 201302
Physical Review B Condensed Matter and Materials Physics
(2004)
69
1
(doi: 10.1103/physrevb.69.201302)
Field-evaporation from first-principles
Molecular Physics
(2004)
102
1045
(doi: 10.1080/00268970410001727673)
Linear screening of the electrostatic potential around spherical particles with non-spherical charge patterns
Molecular Physics
(2004)
102
857
(doi: 10.1080/00268970410001695688)
Some further applications of discrete path sampling to cluster isomerization
Molecular Physics
(2004)
102
891
(doi: 10.1080/00268970410001703363)
Special issue: In honour of Ruth Lynden-Bell
Molecular Physics
(2004)
102
827
(doi: 10.1080/00268970412331286918)
Ammonium cyanate: A DFT study of crystal structure, rotational barriers and vibrational spectrum
Molecular Physics
(2004)
102
869
(doi: 10.1080/00268970410001695679)
Dynamics in crystals of rigid organic molecules: contrasting the phonon frequencies calculated by molecular dynamics with harmonic lattice dynamics for finidazole and 5-azauracil
Molecular Physics
(2004)
102
1067
(doi: 10.1080/00268970412331284208)
