Publications

Tips on using this search form

All search terms are case-insensitive
If you specify more than one search option (e.g. you search for both "Authors" and "Paper title") then the publications returned will be those that match all of your search terms
To reset the search form, click here

Currently displaying 20801 - 20820 of 29607 publications

Ab Initio Molecular Dynamics Study of Uracil in Aqueous Solution

M-P Gaigeot, M Sprik

The Journal of Physical Chemistry B

(2004)

108

7458

(doi: 10.1021/jp049940m)

2H MAS NMR Studies of Deuterated Goethite (α-FeOOD)

KE Cole, Y Paik, RJ Reeder, M Schoonen, CP Grey

The Journal of Physical Chemistry B

(2004)

108

6938

(doi: 10.1021/jp0486090)

Solution-processible conjugated electrophosphorescent polymers.

AJ Sandee, CK Williams, NR Evans, JE Davies, CE Boothby, A Köhler, RH Friend, AB Holmes

Journal of the American Chemical Society

(2004)

126

7041

(doi: 10.1021/ja039445o)

Is an intermediate state populated on the folding pathway of ubiquitin?

HM Went, CG Benitez-Cardoza, SE Jackson

FEBS Lett

(2004)

567

333

(doi: 10.1016/j.febslet.2004.04.089)

Electron correlation in a hard spherical external potential: Wigner molecule formation and hybridization - art. no. 201302

DC Thompson, A Alavi

Physical Review B Condensed Matter and Materials Physics

(2004)

201302

(doi: 10.1103/PhysRevB.69.201302)

Transferable polarizabilities for the alkanes

GJ Williams, AJS *

Molecular Physics

(2004)

102

985

(doi: 10.1080/00268970410001723000)

Ammonium cyanate: a DFT study of crystal structure, rotational barriers and vibrational spectrum

AA *, RJC Brown, S Habershon, KDMH *, RLJ *

Molecular Physics

(2004)

102

869

(doi: 10.1080/00268970410001695679)

Linear screening of the electrostatic potential around spherical particles with non-spherical charge patterns

N Hoffmann, CNL *, J-P Hansen

Molecular Physics

(2004)

102

857

(doi: 10.1080/00268970410001695688)

Field-evaporation from first-principles

CGS *, AY lozovoi, A alavi

Molecular Physics

(2004)

102

1045

(doi: 10.1080/00268970410001727673)

Some further applications of discrete path sampling to cluster isomerization

DJW *

Molecular Physics

(2004)

102

891

(doi: 10.1080/00268970410001703363)

Dynamics in crystals of rigid organic molecules: Contrasting the phonon frequencies calculated by molecular dynamics with harmonic lattice dynamics for imidazole and 5-azauracil

AE Gray, GMD †, M Leslie, SLP *

Molecular Physics

(2004)

102

1067

(doi: 10.1080/00268970412331284208)

Editorial

A Alavi, JP Hansen

Molecular Physics

(2004)

102

827

(doi: 10.1080/00268970412331286918)

An addressable antibody nanoarray produced on a nanostructured surface.

A Bruckbauer, D Zhou, D-J Kang, YE Korchev, C Abell, D Klenerman

J Am Chem Soc

(2004)

126

6508

(doi: 10.1021/ja0317426)

Rhodium Complexes of Sterically Demanding Diphosphonites: Coordination Chemistry and Catalysis

JI van der Vlugt, R Sablong, PCMM Magusin, AM Mills, AL Spek, D Vogt

Organometallics

(2004)

3177

(doi: 10.1021/om0498899)

Multi-step application of immobilized reagents and scavengers: A total synthesis of epothilone C

RI Storer, T Takemoto, PS Jackson, DS Brown, IR Baxendale, SV Ley

Chemistry – A European Journal

(2004)

2529

(doi: 10.1002/chem.200305669)

Prefibrillar amyloid protein aggregates share common features of cytotoxicity

M Bucciantini, G Calloni, F Chiti, L Formigli, D Nosi, CM Dobson, M Stefani

Journal of Biological Chemistry

(2004)

279

31374

(doi: 10.1074/jbc.M400348200)

(1R,4S,5R)-3-Fluoro-1,4,5-trihydroxy-2-cyclohexene-1-carboxylic acid: the fluoro analogue of the enolate intermediate in the reaction catalyzed by type II dehydroquinases.

M Frederickson, AW Roszak, JR Coggins, AJ Lapthorn, C Abell

Organic & Biomolecular Chemistry

(2004)

1592

(doi: 10.1039/b404535a)