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  • Currently displaying 21801 - 21820 of 30170 publications
Author(s)
Publication title
Journal Name
Publication year
The role of the basis set: Assessing density functional theory
AD Boese, JML Martin, NC Handy
The Journal of Chemical Physics
(2003)
119
Applications of manganocene in the synthesis of Mn(II) amide and imide cages
CS Alvarez, A Bashall, AD Bond, D Cave, EA Harron, RA Layfield, MEG Mosquera, M McPartlin, JM Rawson, PT Wood, DS Wright
Dalton Transactions
(2003)
Direct detection of particles formed by laser ablation of matrices during matrix-assisted laser desorption/ionizationt
S Alves, M Kalberer, R Zenobi
Rapid communications in mass spectrometry : RCM
(2003)
17
Engineering and design - Protein design: theory and practice - Editorial overview
L Regan, SE Jackson
Current Opinion in Structural Biology
(2003)
13
Structure of E-coli ketopantoate hydroxymethyl transferase complexed with ketopantoate and Mg2+, solved by locating 160 selenomethionine sites
F von Delft, T Inoue, SA Saldanha, HH Ottenhof, F Schmitzberger, LM Birch, V Dhanaraj, M Witty, AG Smith, TL Blundell, C Abell
Structure
(2003)
11
The folding and design of repeat proteins: reaching a consensus.
ERG Main, SE Jackson, L Regan
Current opinion in structural biology
(2003)
13
Designing redox metalloproteins from bottom-up and top-down perspectives
PD Barker
Current opinion in structural biology
(2003)
13
Comment on “Properly interpreting scanning tunneling microscopy images: the Cu(1 0 0)-c(2 × 2)N surface revisited” by T.E. Wofford, S.M. York and F.M. Leibsle [Surf. Sci. 522 (2003) 47]
SM Driver, DP Woodruff
Surface Science
(2003)
539
Statistical properties of neutral evolution.
U Bastolla, M Porto, HE Roman, M Vendruscolo
Journal of Molecular Evolution
(2003)
57
Calculation of Mutational Free Energy Changes in Transition States for Protein Folding
K Lindorff-Larsen, E Paci, L Serrano, CM Dobson, M Vendruscolo
Biophysical journal
(2003)
85
Synthesis, structure and magnetic characterisation of a new layered ammonium manganese(ii) diphosphate hydrate , (NH 4 ) 2 [Mn 3 (P 2 O 7 ) 2 (H 2 O) 2 ]
AM Chippindale, FOM Gaslain, AD Bond, AV Powell
Journal of Materials Chemistry
(2003)
13
Rapid amyloid fiber formation from the fast-folding WW domain FBP28
N Ferguson, J Berriman, M Petrovich, TD Sharpe, JT Finch, AR Fersht
Proc Natl Acad Sci U S A
(2003)
100
Quantitative Analysis of Polycyclic Aromatic Hydrocarbons in Water in the Low-Nanogram per Liter Range with Two-Step Laser Mass Spectrometry
C Emmenegger, M Kalberer, B Morrical, R Zenobi
Anal Chem
(2003)
75
Quantification of functional group interactions in transition states
CA Hunter, CMR Low, JG Vinter, C Zonta
J Am Chem Soc
(2003)
125
Multicomponent submicron features of biomolecules created by voltage controlled deposition from a nanopipet
A Bruckbauer, D Zhou, L Ying, YE Korchev, C Abell, D Klenerman
J Am Chem Soc
(2003)
125
New building blocks for the assembly of sequence selective molecular zippers
CA Hunter, PS Jones, PMN Tiger, S Tomas
Chemical Communications
(2003)
3
First-principles theory and microcalorimetry of CO adsorption on the {211} surfaces of Pt and Ni
AD Karmazyn, V Fiorin, SJ Jenkins, DA King
Surface Science
(2003)
538
Amyloid protofilaments from the calcium-binding protein equine lysozyme: formation of ring and linear structures depends on pH and metal ion concentration.
M Malisauskas, V Zamotin, J Jass, W Noppe, CM Dobson, LA Morozova-Roche
Journal of Molecular Biology
(2003)
330
Mechanical unfolding of a titin Ig domain: structure of transition state revealed by combining atomic force microscopy, protein engineering and molecular dynamics simulations.
RB Best, SB Fowler, JLT Herrera, A Steward, E Paci, J Clarke
J Mol Biol
(2003)
330
Thermal versus electronic broadening in the density of states of liquid water
P Hunt, M Sprik, R Vuilleumier
Chemical Physics Letters
(2003)
376