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Currently displaying 20461 - 20480 of 29636 publications

Exploring strategies for digital preservation for DSpace@Cambridge

G Carpenter, J Downing

Archiving 2005, Final Program and Proceedings

(2005)

Pathways for dissociative ethane chemisorption on Pt110 (1x2) using density functional theory

AT Anghel, DJ Wales, SJ Jenkins, DA King

Chem. Phys. Lett.

(2005)

413

289-293

Self-assembled monolayers (SAMS) and synthesis of planar micro- and nanostructures

L Yan, WTS Huck, GM Whitesides

Journal of Macromolecular Science Polymer Reviews

(2004)

175

(doi: 10.1081/MC-120034153)

Stresses inside critical nuclei

A Cacciuto, D Frenkel

The Journal of Physical Chemistry B

(2004)

109

6587

(doi: 10.1021/jp0456483)

Computational Investigation of Order, Structure, and Dynamics in Modified Water Models †

RM Lynden-Bell, PG Debenedetti

Journal of Physical Chemistry B

(2004)

109

6527

(doi: 10.1021/jp0458553)

Reversal of protein aggregation provides evidence for multiple aggregated States.

M Calamai, C Canale, A Relini, M Stefani, F Chiti, CM Dobson

Journal of molecular biology

(2004)

346

603

(doi: 10.1016/j.jmb.2004.11.067)

Growth of single-walled carbon nanotubes by the rapid heating of a supported catalyst

YL Li, IA Kinloch, MSP Shaffer, C Singh, J Geng, BFG Johnson, AH Windle

Chemistry of Materials

(2004)

5637

(doi: 10.1021/cm0495111)

Preliminary characterization of two different crystal forms of acylphosphatase from the hyperthermophile archaeon Sulfolobus solfataricus

S Zuccotti, C Rosano, F Bemporad, M Stefani, M Bolognesi

Acta Crystallographica Section F: Structural Biology Communications

(2004)

144

(doi: 10.1107/s1744309104032336)

Exploring the temperature-pressure configurational landscape of biomolecules: from lipid membranes to proteins.

R Winter, W Dzwolak

Philosophical transactions. Series A, Mathematical, physical, and engineering sciences

(2004)

363

537

(doi: 10.1098/rsta.2004.1507)

Towards complete descriptions of the free-energy landscapes of proteins

M Vendruscolo, CM Dobson

Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences

(2004)

363

433

(doi: 10.1098/rsta.2004.1501)

Lowest-energy structures of (C60)nX (X=Li+,Na+,K+,Cl−) and (C60)nYCl (Y=Li,Na,K) clusters for n⩽13

J Hernández-Rojas, J Bretón, JM Gomez Llorente, DJ Wales

The Journal of chemical physics

(2004)

121

12315

(doi: 10.1063/1.1819894)

Mapping long-range interactions in α-synuclein using spin-label NMR and ensemble molecular dynamics simulations

MM Dedmon, K Lindorff-Larsen, J Christodoulou, M Vendruscolo, CM Dobson

J Am Chem Soc

(2004)

127

476

(doi: 10.1021/ja044834j)

Identification of Novel p38α MAP Kinase Inhibitors Using Fragment-Based Lead Generation

AL Gill, M Frederickson, A Cleasby, SJ Woodhead, MG Carr, AJ Woodhead, MT Walker, MS Congreve, LA Devine, D Tisi, M O'Reilly, LCA Seavers, DJ Davis, J Curry, R Anthony, A Padova, CW Murray, RAE Carr, H Jhoti

Journal of Medicinal Chemistry

(2004)

414

(doi: 10.1021/jm049575n)

Fragment-Based Lead Discovery Using X-ray Crystallography

MJ Hartshorn, CW Murray, A Cleasby, M Frederickson, IJ Tickle, H Jhoti

J Med Chem

(2004)

403

(doi: 10.1021/jm0495778)

Quantifying the complexity of chaos in multibasin multidimensional dynamics of molecular systems

D Nerukh, G Karvounis, RC Glen