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Yusuf Hamied Department of Chemistry

 

Publications

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  • Currently displaying 22221 - 22240 of 27826 publications
Determining surface free energies of crystals with highly disordered surfaces from simulation
P Smith, RM Lynden-Bell
– Molecular Physics
(1999)
96,
1027
(doi: 10.1080/002689799164856)
Density functional calculations of the hyperpolarisabilities of small molecules
AJ Cohen, NC Handy, DJ Tozer
– Chemical Physics Letters
(1999)
303,
391
(doi: 10.1016/s0009-2614(99)00248-1)
The mechanism of thickness selection in the Sadler-Gilmer model of polymer crystallization
JPK Doye, D Frenkel
– The Journal of Chemical Physics
(1999)
110,
7073
(doi: 10.1063/1.478613)
The double-funnel energy landscape of the 38-atom Lennard-Jones cluster
JPK Doye, MA Miller, DJ Wales
– The Journal of Chemical Physics
(1999)
110,
6896
(doi: 10.1063/1.478595)
Modeling small hydronium-water clusters
MP Hodges, AJ Stone
– The Journal of Chemical Physics
(1999)
110,
6766
(doi: 10.1063/1.478580)
A leaving group strategy for the selective functionalisation of an imido Sn(II) cubane
B Galan, MEG Mosquera, JS Palmer, PR Raithby, DS Wright
– Dalton Transactions
(1999)
1043
(doi: 10.1039/a901478k)
Pressure-induced structural changes of HBr
T Ikeda, M Sprik, K Terakura, M Parrinello
– Physica B: Condensed Matter
(1999)
265,
101
(doi: 10.1016/s0921-4526(98)01333-7)
13C CP/MAS NMR study of anti-HIV-1 agent AZT
W Kolodziejski, J Klinowski
– Chemical Physics Letters
(1999)
303,
183
(doi: 10.1016/s0009-2614(99)00193-1)
Short-time dynamics of colloidal suspensions in confined geometries
I Pagonabarraga, MHJ Hagen, CP Lowe, D Frenkel
– Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics
(1999)
59,
4458
(doi: 10.1103/PhysRevE.59.4458)
Optimized Lieb-Oxford bound for the exchange-correlation energy
GKL Chan, NC Handy
– Physical Review A
(1999)
59,
3075
(doi: 10.1103/PhysRevA.59.3075)
Anharmonicity and localization of atomic vibrations in vitreous silica
SN Taraskin, SR Elliott
– Physical Review B - Condensed Matter and Materials Physics
(1999)
59,
8572
(doi: 10.1103/physrevb.59.8572)
Products of the ultraviolet photodissociation of trifluoroacetic acid and acrylic acid
MC Osborne, Q Li, IWM Smith
– Physical Chemistry Chemical Physics
(1999)
1,
1447
(doi: 10.1039/a809064e)
Nematic–isotropic transition in polydisperse systems of infinitely thin hard platelets
MA Bates, D Frenkel
– The Journal of Chemical Physics
(1999)
110,
6553
(doi: 10.1063/1.478558)
Kinetic-energy systems, density scaling, and homogeneity relations in density-functional theory
GKL Chan, NC Handy
– Physical Review A
(1999)
59,
2670
(doi: 10.1103/physreva.59.2670)
Mechanical and chemical unfolding of a single protein: a comparison.
M Carrion-Vazquez, AF Oberhauser, SB Fowler, PE Marszalek, SE Broedel, J Clarke, JM Fernandez
– Proceedings of the National Academy of Sciences
(1999)
96,
3694
(doi: 10.1073/pnas.96.7.3694)
Mutually compensatory mutations during evolution of the tetramerization domain of tumor suppressor p53 lead to impaired hetero-oligomerization.
MG Mateu, AR Fersht
– Proceedings of the National Academy of Sciences
(1999)
96,
3595
(doi: 10.1073/pnas.96.7.3595)
Designing conditions for in vitro formation of amyloid protofilaments and fibrils
F Chiti, P Webster, N Taddei, A Clark, M Stefani, G Ramponi, CM Dobson
– Proc Natl Acad Sci U S A
(1999)
96,
3590
(doi: 10.1073/pnas.96.7.3590)
A kinetic and spectroscopic study of the in situ electrochemical promotion by sodium of the platinum-catalyzed combustion of propene
NC Filkin, MS Tikhov, A Palermo, RM Lambert
– The Journal of Physical Chemistry A
(1999)
103,
2680
(doi: 10.1021/jp984186o)
Actions of azadirachtin, a plant allelochemical, against insects
AJ Mordue, MSJ Simmonds, SV Ley, WM Blaney, W Mordue, M Nasiruddin, AJ Nisbet
– Pesticide Science
(1999)
54,
277
(doi: 10.1002/(sici)1096-9063(1998110)54:3<277::aid-ps801>3.0.co;2-i)
Selective inhibition of type II dehydroquinases
M Frederickson, EJ Parker, AR Hawkins, JR Coggins, C Abell
– The Journal of organic chemistry
(1999)
64,
2612
(doi: 10.1021/jo990004q)

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