Molecular Simulation, Volume 30, Issue 7 (2004)

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Molecular Simulation, Volume 30, Issue 7 (2004)

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Foundations of Molecular Modelling and Simulation—FOMMS 2003 (Part II)

Original Articles

Article
Optimal Site Charge Models for Molecular Electrostatic Potentials
Panagiotis G. Karamertzanis & Constantinos C. Pantelides
Pages: 413-436
Published online: 31 Jan 2007
AbstractforOptimal Site Charge Models for Molecular Electrostatic Potentials | Full Text | References | PDF (770.5 KB)
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Article
The Depletion Attraction between Pairs of Colloid Particles in Polymer Solution
Alberto Striolo, Coray M. Colina, Keith E. Gubbins, Nicola Elvassore & Leo Lue
Pages: 437-449
Published online: 31 Jan 2007
AbstractforThe Depletion Attraction between Pairs of Colloid Particles in Polymer Solution | Full Text | References | PDF (898.8 KB)
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Article
Prediction of the Liquid Viscosities of Pure Components and Mixtures Using Neural Network and ASOG Group Contribution Methods
Akimitsu Murata, Katsumi Tochigi & Hiroshi Yamamoto
Pages: 451-457
Published online: 31 Jan 2007
AbstractforPrediction of the Liquid Viscosities of Pure Components and Mixtures Using Neural Network and ASOG Group Contribution Methods | Full Text | References | PDF (102.4 KB)
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Article
Development of a model for the Description of Intra-diffusion in Homogeneous Liquid Lennard–Jones Mixtures
Tatiana Merzliak & Andreas Pfennig
Pages: 459-468
Published online: 31 Jan 2007
AbstractforDevelopment of a model for the Description of Intra-diffusion in Homogeneous Liquid Lennard–Jones Mixtures | Full Text | References | PDF (140.1 KB)
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Article
3D Visualization of Molecular Simulations in High-performance Parallel Computing Environments
Karsten Meier, Christopher Holzknecht, Stephan Kabelac, Stephan Olbrich & Karsten Chmielewski
Pages: 469-477
Published online: 31 Jan 2007
Abstractfor3D Visualization of Molecular Simulations in High-performance Parallel Computing Environments | Full Text | References | PDF (532 KB)
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Article
Industrial Uses of Computational Models in the Development of Novel Nanosystems
Cristina U. Thomas, Gregg A. Caldwell, Sanat Mohanty, Tommie W. Kelley & DeNnis Vogel
Pages: 479-486
Published online: 31 Jan 2007
AbstractforIndustrial Uses of Computational Models in the Development of Novel Nanosystems | Full Text | References | PDF (592.9 KB)
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