Models of Solute Aggregation Using Cellular Automata

Autor:	Lemont B. Kier, Cho-Kun Cheng, Jean D. Nelson
Rok vydání:	2009
Předmět:	Stereochemistry Chemistry Bioengineering General Chemistry General Medicine Models Biological Biochemistry Cellular automaton Solutions Models Chemical Solubility Molecular Medicine Biological system Hydrophobic and Hydrophilic Interactions Molecular Biology
Zdroj:	Chemistry & Biodiversity. 6:396-401
ISSN:	1612-1880 1612-1872
Popis:	A series of models using cellular automata (CA) are created to examine the influences on the phenomenon of solute aggregation. The models used the variations in hydropathic states of the solutes to produce changes in the clustering patterns. It was found that an increase in the hydrophobic character of the solute molecules led to greater aggregation. The effect of concentration of solutes was also modeled. These preliminary models of solute aggregation serve as the basis for subsequent models relative to both biological receptor interactions, and the fate and transport of environmental contaminants of interest.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_dedup___::82ccfc5c7a913fdd3e1528c7bd824a47 https://doi.org/10.1002/cbdv.200800285 Zobrazit plný text záznamu Plný text