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An approach to the multiple-minima problem by relaxing dimensionality.

A method is presented for starting from a very-low-energy high-dimensional conformation and obtaining a low-energy three-dimensional structure by gradual contraction of the dimensionality. The contraction in dimensionality is achieved by use of Cayley-Menger determinants, of which a simplified form...

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Detalhes bibliográficos
Main Authors: Purisima, E O, Scheraga, H A
Formato: Artigo
Idioma:Inglês
Publicado em: 1986
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC323390/
https://ncbi.nlm.nih.gov/pubmed/3458240
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