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Molecular dynamics of a polymer chain with a crosslink

โœ Scribed by I.M. Neyelov; A.A. Darinskii; Yu.Ya. Gotlib; N.K. Balabayev


Book ID
118966699
Publisher
Elsevier Science
Year
1980
Weight
672 KB
Volume
22
Category
Article
ISSN
0032-3950

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Molecular dynamics simulation of a polym
โœ LEMAK, A. S.; BALABAEV, N. K. ๐Ÿ“‚ Article ๐Ÿ“… 1996 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 834 KB

This article describes the collisional dynamics (CD) method adapted for molecules with geometrical constraints within a description using Cartesian coordinates for the atoms. In the CD method, stochastic collisions with virtual particles are included in usual molecular dynamics simulations to couple