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MiS Preprint

An Atomistic to Continuum Model for Biopolymers Self-Assembled Aggregation

Leonid Berlyand, Maxim V. Fedorov and Lei Zhang


We want to address the following problem of hierarchical modeling of the structure of biopolymer self-assembly, and relate the marcoscale mechanical and geometrical property to their microscale molecular property, for example, how to link the chirality and the amphiphilicity of the single amino acid to the shape of their supramolecular aggregates, or mathematically, how to derive the elastic parameters from the parameters at the atomistic scale.

Jul 14, 2009
Jul 14, 2009
MSC Codes:
74, 92, 65
Atomistic to Continuum, Self-Assembled Aggregation, discrete curvature

Related publications

2009 Repository Open Access
Leonid V. Berlyand, Maxim V. Fedorov and Lei Zhang

An atomistic to continuum model for biopolymers self-assembled aggregation