Cellular Automata for Simulating Molecular Self-Assembly

We present a lattice gas technique for simulating molecular self-assembly of amphiphilic polymers in aqueous environments. Water molecules, hydrocarbons tail-groups and amphiphilic head-groups are explicitly represented on a three dimensional discrete lattice. Molecules move on the lattice proportio...

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Bibliografiske detaljer

Principais autores:	Martin Nilsson, Steen Rasmussen
Format:	Artigo
Sprog:	Inglês
Udgivet:	Discrete Mathematics & Theoretical Computer Science 2003-01-01
Serier:	Discrete Mathematics & Theoretical Computer Science
Fag:	cellular automata lattice gas molecular self-assembly statistical mechanics thermodynamics [info.info-dm] computer science [cs]/discrete mathematics [cs.dm] [math.math-co] mathematics [math]/combinatorics [math.co] [nlin.nlin-cg] nonlinear sciences [physics]/cellular automata and lattice gases [nlin.cg] [info.info-hc] computer science [cs]/human-computer interaction [cs.hc]
Online adgang:	https://dmtcs.episciences.org/2309/pdf
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