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  • Currently displaying 22741 - 22760 of 29853 publications
Author(s)
Publication title
Journal Name
Publication year
Protein Folding Using Inter-Residue Contacts
M Vendruscolo
Proceedings 1st International Symposium on 3D Data Processing Visualization and Transmission 3dpvt 2002
(2002)
83
Theoretical determination of the vibrational levels of NH3+ with MULTIMODE
C Léonard, S Carter, NC Handy
Phys. Chem. Chem. Phys.
(2002)
4
A study of the known and hypothetical crystal structures of pyridine: why are there four molecules in the asymmetric unit cell?
AT Anghel, GM Day, SL Price
CrystEngComm
(2002)
4
High-throughput crystallography for lead discovery in drug design.
TL Blundell, H Jhoti, C Abell
Nature Reviews Drug Discovery
(2002)
1
The use of XANES and ELNES for the characterisation of stabilised zirconia
DW McComb, S Ostanin, D Vlachos, AJ Craven, MW Finnis, AT Paxton, A Alavi
Materials Research Society Symposium Proceedings
(2002)
699
Ag-Catalysed Epoxidation of Propene and Ethene: An Investigation Using Electrochemical Promotion of the Effects of Alkali, NOX, and Chlorine
A Palermo, A Husain, MS Tikhov, RM Lambert
Journal of Catalysis
(2002)
207
Palladium Acetate in Polyurea Microcapsules: A Recoverable and Reusable Catalyst for Hydrogenations
SV Ley, N Bremeyer, C Ramarao, IM Shirley, SC Smith
Synlett
(2002)
2002
Rate coefficients for rotational energy transfer from the levels OH(X2Π3/2, v = 1, ji = 1.5, 3.5–8.5) in collisions with He, Ar, N2and HNO3
KM Hickson, CM Sadowski, IWM Smith
Physical Chemistry Chemical Physics
(2002)
4
Concomitant polymorphs: structural studies on the trimorphic dithiadiazolyl radical, ClCNSSN
AD Bond, DA Haynes, CM Pask, JM Rawson
Journal of the Chemical Society Dalton Transactions
(2002)
Effective interactions for large-scale simulations of complex fluids
JP Hansen, H Löwen
BRIDGING TIME SCALES: MOLECULAR SIMULATIONS FOR THE NEXT DECADE
(2002)
605
Constructing a map from the electron density to the exchange-correlation potential
JB Lucks, AJ Cohen, NC Handy
Physical Chemistry Chemical Physics
(2002)
4
New Directions: Mobile laboratory reveals new issues in urban air quality
PW Seakins, DL Lansley, A Hodgson, N Huntley, F Pope
Atmospheric Environment
(2002)
36
Propene Epoxidation over K-Promoted Ag/CaCO3 Catalysts: The Effect of Metal Particle Size
FW Zemichael, A Palermo, MS Tikhov, RM Lambert
Catalysis Letters
(2002)
80
The superstructure of lead tetragonal tungsten bronze
SK Haydon, DA Jefferson
Journal of Solid State Chemistry
(2002)
168
C-H•••π interactions in the low-temperature crystal structures of α,ω-unsaturated linear hydrocarbons
AD Bond
Chemical communications (Cambridge, England)
(2002)
Diatomics-in-molecules potentials incorporating ab initio data: Application to ionic, Rydberg-excited, and molecule-doped rare gas clusters
FY Naumkin, DJ Wales
Compu. Phys. Comm.
(2002)
145
Diagnosis of mixing between middle latitudes and the polar vortex from tracer-tracer correlations
O Morgenstern, JA Pyle, AM Iwi, WA Norton, JW Elkins, DF Hurst, PA Romashkin
Journal of Geophysical Research Atmospheres
(2002)
107
17O MQMAS NMR studies of Na-A and Ca-A
JE Readman, N Kim, M Ziliox, CP Grey
Chemical Communications
(2002)
2
A new Chemical Lagrangian Model of the Stratosphere (CLaMS) 2. Formulation of chemistry scheme and initialization
DS McKenna, J-U Grooß, G Günther, P Konopka, R Müller, G Carver, Y Sasano
Journal of Geophysical Research D: Atmospheres
(2002)
107
Sensitive and direct detection using rupture event scanning (REVS/spl trade/)
S Kelling, MA Cooper, K Stirrups, R Karamanska, VP Ostanin, D Klenerman, A Slepstov, M Rehak, FN Dultsev, T Minson, C Abell
Proceedings of the 2002 IEEE International Frequency Control Symposium and PDA Exhibition (Cat. No.02CH37234)
(2002)
1