Comparing distance metrics for rotation using the k-nearest neighbors algorithm for entropy estimation

Distance metrics facilitate a number of methods for statistical analysis. For statistical mechanical applications, it is useful to be able to compute the distance between two different orientations of a molecule. However, a number of distance metrics for rotation have been employed, and in this stud...

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Detalles Bibliográficos
Autor principal: Huggins, David J
Formato: Online Artículo Texto
Lenguaje:English
Publicado: BlackWell Publishing Ltd 2014
Materias:
Full Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4238811/
https://www.ncbi.nlm.nih.gov/pubmed/24311273
http://dx.doi.org/10.1002/jcc.23504

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4238811/
https://www.ncbi.nlm.nih.gov/pubmed/24311273
http://dx.doi.org/10.1002/jcc.23504

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