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  • Currently displaying 24081 - 24100 of 31130 publications
Author(s)
Publication title
Journal Name
Publication year
Chapter 8 The Gibbs Ensemble
D Frenkel, B Smit
(2002)
High-throughput crystallography for lead discovery in drug design
TL Blundell, H Jhoti, C Abell
Nature Reviews Drug Discovery
(2002)
1
Other Methods to Study Coexistence
D Frenkel, B Smit
(2002)
Chapter 10 Free Energies of Solids
D Frenkel, B Smit
(2002)
Chapter 11 Free Energy of Chain Molecules
D Frenkel, B Smit
(2002)
Long-Range Interactions
D Frenkel, B Smit
(2002)
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
Theoretical determination of the vibrational levels of NH3+ with MULTIMODE
C Léonard, S Carter, NC Handy
Physical Chemistry Chemical Physics
(2002)
4
Biased Monte Carlo Schemes
D Frenkel, B Smit
(2002)
Oxygen scavenging by lithium zincates: the synthesis, structural characterisation and derivatisation of [Ph(2-C 5 H 4 N)N] 2 ZnRLi· n thf (R = Bu t , Bu n ; n = 1, 2)
SR Boss, R Haigh, DJ Linton, AEH Wheatley
Journal of the Chemical Society Dalton Transactions
(2002)
Accelerating Monte Carlo Sampling
D Frenkel, B Smit
(2002)
Designing neutral coordination networks with the aid of hydrogen bond mimicry using silver(i) carboxylates
L Brammer, MD Burgard, MD Eddleston, CS Rodger, NP Rath, H Adams
Crystengcomm
(2002)
4
C-H⋯π interactions in the low-temperature crystal structures of α,Ω-unsaturated linear hydrocarbons
AD Bond
Chemical Communications
(2002)
2
Chapter 15 Tackling Time-Scale Problems
D Frenkel, B Smit
(2002)
Rare Events
D Frenkel, B Smit
(2002)
Chapter 17 Dissipative Particle Dynamics
D Frenkel, B Smit
(2002)
The preparation of chromium, nickel and chromium–nickel alloy nanoparticles on supports
RD Tilley, DA Jefferson
J. Mater. Chem.
(2002)
12
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
New Look and New Outlook
WA Hendrickson, C-I Brändén, AR Fersht
Structure
(2002)
10
OmpA: A pore or not a pore? Simulation and modeling studies
PJ Bond, JD Faraldo-Gómez, MSP Sansom
Biophysical Journal
(2002)
83