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Confidence limits, error bars and method comparison in molecular modeling. Part 1: The calculation of confidence intervals

Computational chemistry is a largely empirical field that makes predictions with substantial uncertainty. And yet the use of standard statistical methods to quantify this uncertainty is often absent from published reports. This article covers the basics of confidence interval estimation for molecula...

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Detalles Bibliográficos
Autor principal: Nicholls, A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4175406/
https://www.ncbi.nlm.nih.gov/pubmed/24899109
http://dx.doi.org/10.1007/s10822-014-9753-z

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