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  • Currently displaying 19621 - 19640 of 29290 publications
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Automatic aggregation of open chemical data
NE Day, P Murray-Rust, HS Rzepa, SM Tyrrell, Y Zhang
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2005)
230
Origins of catalytic activity in oxide-supported gold: Ultra-small particles and fungiform nanostructures
Z Liu, SJ Jenkins, DA King
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2005)
230
Computational chemistry robots
JA Townsend, P Murray-Rust, SM Tyrrell, Y Zhang
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2005)
230
Form of growing strings.
D Marenduzzo, TX Hoang, F Seno, M Vendruscolo, A Maritan
Physical review letters
(2005)
95
Evidence for a Mechanism of Amyloid Formation Involving Molecular Reorganisation within Native-like Precursor Aggregates
G Plakoutsi, F Bemporad, M Calamai, N Taddei, CM Dobson, F Chiti
Journal of molecular biology
(2005)
351
Quaternary Stereocenters
P Nolan
(2005)
Global minima and energetics of Li+(H2O), and Ca2+(H2O)n clusters for n≤20
BS González, J Hernández-Rojas, DJ Wales
Chem. Phys. Lett.
(2005)
412
Structural chemistry and magnetic properties of Nd 2BaLiRuO 7
JA Rodgers, PD Battle, CP Grey, J Sloan
Chemistry of Materials
(2005)
17
Simultaneous local and long range structure determination: application to in-situ studies
PJ Chupas, CP Grey
Acta Crystallographica Section A Foundations of Crystallography
(2005)
61
PDF and NMR Study of Ordering in the Positive Electrode Material Li(NiMn)0.5O2
J Bréger, N Dupré, PJ Chupas, PL Lee, T Proffen, JB Parise, CP Grey
Acta Crystallographica Section A: Foundations and advances
(2005)
61
Fragment-based Screening by X-ray Crystallography: An Alternative to High-throughput Screening
A Cleasby, L Devine, M Frederickson, M Hartshorn, I Tickle, A Sharff, M O'Reilly, D Tisi
Acta Crystallographica Section A Foundations of Crystallography
(2005)
61
A highly selective, organocatalytic route to chiral dihydro-1,2-oxazines
S Kumarn, DM Shaw, DA Longbottom, SV Ley
Organic letters
(2005)
7
Determination of the folding transition states of barnase by using PhiI-value-restrained simulations validated by double mutant PhiIJ-values.
X Salvatella, CM Dobson, AR Fersht, M Vendruscolo
Proceedings of the National Academy of Sciences
(2005)
102
Total synthesis of Spongistatin 1: A synthetic strategy exploiting its latent pseudo-symmetry
M Ball, MJ Gaunt, DF Hook, AS Jessiman, S Kawahara, P Orsini, A Scolaro, AC Talbot, HR Tanner, S Yamanoi, SV Ley
Angewandte Chemie (International ed. in English)
(2005)
44
Oxidative Refolding of Amyloidogenic Variants of Human Lysozyme
R Wain, LJ Smith, CM Dobson
Journal of Molecular Biology
(2005)
351
Synthesis of the EF Fragment of Spongistatin 1
SV Ley, S Kawahara, MJ Gaunt, A Scolaro, S Yamanoi
Synlett
(2005)
Chemistry: Theoretical study of geometric phase effects in the hydrogen-exchange reaction
JC Juanes-Marcos, SC Althorpe, E Wrede
Science
(2005)
309
Crystalline−Crystalline Block Copolymers of Regioregular Poly(3-hexylthiophene) and Polyethylene by Ring-Opening Metathesis Polymerization
CP Radano, OA Scherman, N Stingelin-Stutzmann, C Müller, DW Breiby, P Smith, RAJ Janssen, EW Meijer
J Am Chem Soc
(2005)
127
Tuning of redox properties for the design of ruthenium anticancer drugs: part 2. Syntheses, crystal structures, and electrochemistry of potentially antitumor [Ru III/II Cl6-n(Azole)n]z(n = 3, 4, 6) complexes.
E Reisner, VB Arion, A Eichinger, N Kandler, G Giester, AJL Pombeiro, BK Keppler
Inorganic chemistry
(2005)
44
Toward the Synthesis of Spirastrellolide A:  Construction of Two C1−C25 Diastereomers Containing the BC−Spiroacetal
I Paterson, EA Anderson, SM Dalby, O Loiseleur
Organic Letters
(2005)
7