Publications | Yusuf Hamied Department of Chemistry

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Currently displaying 23281 - 23300 of 30303 publications

Chapter 4 Molecular Dynamics Simulations

D Frenkel, B Smit

(2002)

63

(doi: 10.1016/b978-012267351-1/50006-7)

Chapter 14 Accelerating Monte Carlo Sampling

D Frenkel, B Smit

(2002)

389

(doi: 10.1016/b978-012267351-1/50016-x)

Self-assembly of porphyrin arrays

L Baldini, CA Hunterf

Advances in Inorganic Chemistry

(2002)

53

213

(doi: 10.1016/s0898-8838(02)53006-3)

Structures of adsorbed water layers on MgO: An ab initio study

RM Lynden-Bell, L Delle Site, A Alavi

Surface Science

(2002)

496

l1

(doi: 10.1016/s0039-6028(01)01669-7)

Diode laser spectrum of the v1 fundamental band of PNO

Y Liu, PA Hamilton, PB Davies

Journal of Molecular Spectroscopy

(2002)

211

107

(doi: 10.1006/jmsp.2001.8487)

The Superstructure of Lead Tetragonal Tungsten Bronze

SK Haydon, DA Jefferson

Journal of Solid State Chemistry

(2002)

168

306

(doi: 10.1006/jssc.2002.9630)

Dissipative Particle Dynamics

D Frenkel, B Smit

(2002)

465

(doi: 10.1016/b978-012267351-1/50019-5)

Chapter 1 Introduction

D Frenkel, B Smit

(2002)

1

(doi: 10.1016/b978-012267351-1/50003-1)

Chapter 5 Monte Carlo Simulations in Various Ensembles

D Frenkel, B Smit

(2002)

111

(doi: 10.1016/b978-012267351-1/50007-9)

New look and new outlook

WA Hendrickson, C-I Brändén, AR Fersht

Structure

(2002)

10

1

(doi: 10.1016/s0969-2126(01)00704-3)

Isothermal and temperature-programmed oxidation of CH over Pt(1 1 0)-(1 × 2)

DTP Watson, JJW Harris, DA King

Surface Science

(2002)

505

58

(doi: 10.1016/S0039-6028(01)01679-X)

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

1247

(doi: 10.1016/s1352-2310(01)00584-2)

Preface

SV Ley

(2002)

27

7

(doi: 10.1016/S1572-5995(02)80031-X)

Chapter 15 Tackling Time-Scale Problems

D Frenkel, B Smit

(2002)

409

(doi: 10.1016/b978-012267351-1/50017-1)

Chapter 7 Free Energy Calculations

D Frenkel, B Smit

(2002)

167

(doi: 10.1016/b978-012267351-1/50009-2)

Energetics of enzyme stability.

M Vendruscolo

Trends in biotechnology

(2002)

20

1

(doi: 10.1016/s0167-7799(01)01871-6)

What can classical simulators learn from ab initio simulations?

L Delle Site, RM Lyndeb-Bell, A Alavi

Journal of Molecular Liquids

(2002)

98

79

(doi: 10.1016/S0167-7322(01)00311-7)

Molecular Dynamics in Various Ensembles

D Frenkel, B Smit

(2002)

139

(doi: 10.1016/b978-012267351-1/50008-0)

Coverage dependence of the dissociative sticking probability of methane on Pt(1 1 0)-(1 × 2)

DTP Watson, J van Dijk, JJW Harris, DA King

Surface Science

(2002)

506

243

(doi: 10.1016/S0039-6028(02)01315-8)

OmpA: A pore or not a pore? Simulation and modeling studies

PJ Bond, JD Faraldo-Gómez, MSP Sansom

Biophysical Journal

(2002)

83

763

(doi: 10.1016/S0006-3495(02)75207-7)