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  • Currently displaying 24041 - 24060 of 31108 publications
Author(s)
Publication title
Journal Name
Publication year
Improved synthesis of dithieno[3,2- b :2′,3′- d ]thiophene (DTT) and derivatives for cross coupling
J Frey, AD Bond, AB Holmes
Chem Commun (Camb)
(2002)
2
Tackling Time-Scale Problems
D Frenkel, B Smit
(2002)
Chapter 6 Molecular Dynamics in Various Ensembles
D Frenkel, B Smit
(2002)
Protein folding using inter-residue contacts
M Vendruscolo
Proceedings 1st International Symposium on 3D Data Processing Visualization and Transmission 3dpvt 2002
(2002)
83
17O MQMAS NMR studies of Na-A and Ca-A
JE Readman, N Kim, M Ziliox, CP Grey
Chemical Communications
(2002)
2
A solid state and theoretical study of the solvent effects controlling the mono- and di-lithiation of aromatic primary amines
DR Armstrong, SC Ball, D Barr, W Clegg, DJ Linton, LC Kerr, D Moncrieff, PR Raithby, RJ Singer, R Snaith, D Stalke, AEH Wheatley, DS Wright
Dalton Transactions
(2002)
Rate coefficients for rotational energy transfer from the levels OH(X (2)Pi(3/2), v=1, j(i)=1.5, 3.5-8.5) in collisions with He, Ar, N-2 and HNO3
KM Hickson, CM Sadowski, IWM Smith
Physical Chemistry Chemical Physics
(2002)
4
Developing tools and standards in molecular informatics
R Glen
Chemical Communications
(2002)
Accelerating Monte Carlo Sampling
D Frenkel, B Smit
(2002)
Biased Monte Carlo Schemes
D Frenkel, B Smit
(2002)
Long-Range Interactions
D Frenkel, B Smit
(2002)
Chapter 11 Free Energy of Chain Molecules
D Frenkel, B Smit
(2002)
Syntheses and structures of the cubanes [PhOSb(mu(3)-NCy)](4) and [pyOBi(mu(3)-NCy)](4) (Cy = cyclohexyl, py=2-pyridyl)
JF Bickley, AD Bond, F García, K Jantos, GT Lawson, M McPartlin, A Steiner, DS Wright
Dalton Transactions
(2002)
H2−D2 exchange and migration of Ga in H-ZSM5 and H-MOR zeolites
M Garcia-Sanchez, P Magusin, EJM Hensen, RA van Santen
(2002)
142
Synthesis and characterisation of super-microporous aluminosilicates prepared via primary amine templating
E Bastardo-Gonzalez, R Mokaya, W Jones
Studies in Surface Science and Catalysis
(2002)
141
Chapter 7 Free Energy Calculations
D Frenkel, B Smit
(2002)
The Gibbs Ensemble
D Frenkel, B Smit
(2002)
Other Methods to Study Coexistence
D Frenkel, B Smit
(2002)
Free Energies of Solids
D Frenkel, B Smit
(2002)
What can classical simulators learn from ab initio simulations?
L Delle Site, RM Lyndeb-Bell, A Alavi
Journal of Molecular Liquids
(2002)
98-99