Topographical complexity of multidimensional energy landscapes

A scheme for visualizing and quantifying the complexity of multidimensional energy landscapes and multiple pathways is presented employing principal component-based disconnectivity graphs and the Shannon entropy of relative “sizes” of superbasins. The principal component-based disconnectivity graphs...

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Main Authors: Rylance, Gareth J., Johnston, Roy L., Matsunaga, Yasuhiro, Li, Chun-Biu, Baba, Akinori, Komatsuzaki, Tamiki
Format: Artigo
Jezik:Inglês
Izdano: National Academy of Sciences 2006
Teme:
Biological Sciences
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC1693700/
https://ncbi.nlm.nih.gov/pubmed/17132739
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0608517103
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