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Currently displaying 21621 - 21640 of 29639 publications

Sectorization of a Lamellar Polymer Crystal Studied by Dynamic Monte Carlo Simulations

W Hu, D Frenkel, VBF Mathot

Macromolecules

(2003)

549

(doi: 10.1021/ma025853l)

A computational and experimental search for polymorphs of parabanic acid - A salutary tale leading to the crystal structure of oxo-ureido-acetic acid methyl ester

TC Lewis, DA Tocher, GM Day, SL Price

Crystengcomm

(2003)

(doi: 10.1039/b211784c)

Supramolecular architectures of cyclohexane-1, 3cis, 5cis-tricarboxylic acid in acid∶base complexes

N Shan, AD Bond, W Jones

New Journal of Chemistry

(2003)

365

(doi: 10.1039/b208686g)

Calculation of the melting point of NaCl by molecular simulation

J Anwar, D Frenkel, MG Noro

The Journal of Chemical Physics

(2003)

118

728

(doi: 10.1063/1.1522375)

Self-consistent determination of the transition state for protein folding: Application to a fibronectin type III domain

E Paci, J Clarke, A Steward, M Vendruscolo, M Karplus

Proceedings of the National Academy of Sciences of the United States of America

(2003)

100

394

(doi: 10.1073/pnas.232704999)

Relaxation of HCl(v = 1) and DCl(v = 1) by Cl and O atoms

R Brown, G Glass, I Smith

IEEE Journal of Quantum Electronics

(2003)

695

(doi: 10.1109/JQE.1975.1068742)

Vibrational relaxation in potentially reactive collisions: Temperature and isotope effects

I Smith

IEEE Journal of Quantum Electronics

(2003)

696

(doi: 10.1109/jqe.1975.1068699)

Vibrational relaxation of carbon monoxide (4 ≤ v ≤ 11) at 85 K

C Wittig, I Smith

IEEE Journal of Quantum Electronics

(2003)

196

(doi: 10.1109/jqe.1973.1077350)

Structures and thermodynamic phase transitions for oxygen and silver oxide phases on Ag{1 1 1}

A Michaelides, M-L Bocquet, P Sautet, A Alavi, DA King

Chemical Physics Letters

(2003)

367

344

(doi: 10.1016/S0009-2614(02)01699-8)

A Convenient Method for the Synthesis of Dehydroquinic Acid

C Le Sann, C Abell, AD Abell

Synthetic Communications

(2003)

527

(doi: 10.1081/SCC-120015805)

A tilt-dependent diffusional potential energy landscape: benzyne on Ir{100}

S Yamagishi, SJ Jenkins, DA King

Chemical Physics Letters

(2003)

367

116

(doi: 10.1016/s0009-2614(02)01549-x)

Cooperativity, partially bound states, and enthalpy-entropy compensation.

CA Hunter, S Tomas

Chemistry & Biology

(2003)

1023

(doi: 10.1016/j.chembiol.2003.10.009)

Pressure broadening of the lowest rotational transition of H³⁵Cl by N₂ and O₂

L Zu, PA Hamilton, KV Chance, PB Davies

Journal of Molecular Spectroscopy

(2003)

220

107

(doi: 10.1016/S0022-2852(03)00096-1)

Structure of solid monolayers and multilayers of n-hexane on graphite

M Krishnan, S Balasubramanian, S Clarke

Proceedings of the Indian Academy of Sciences Chemical Sciences

(2003)

115

663

(doi: 10.1007/bf02708256)

Properties and prediction of mitochondrial transit peptides from Plasmodium falciparum.

A Bender, GG van Dooren, SA Ralph, GI McFadden, G Schneider

Molecular and Biochemical Parasitology

(2003)

132

(doi: 10.1016/j.molbiopara.2003.07.001)

2P-0535 Short term remodelling of the aorta of cholesterol fed New Zealand White (NZW) rabbits shown by high-resolution magnetic resonance imaging (MRI)

L Hegyi, AL Busza, PD Hockings, JN Skepper, TA Carpenter, GA Whelan, DC Grimsditch, P Overend, GM Benson, DG Reid, KE Suckling, PL Weissberg

Atherosclerosis Supplements

(2003)

157

(doi: 10.1016/S1567-5688(03)90674-X)

Cutting edge approaches to drug design

A Bender

Drug Discovery Today

(2003)

(doi: 10.1016/s1478-5382(03)02335-7)