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A Chemical Group Graph Representation for Efficient High-Throughput Analysis of Atomistic Protein Simulations

Graphs are rapidly becoming a powerful and ubiquitous tool for the analysis of protein structure and for event detection in dynamical protein systems. Despite their rise in popularity, however, the graph representations employed to date have shared certain features and parameters that have not been...

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Detalhes bibliográficos
Main Authors: BENSON, NOAH C., DAGGETT, VALERIE
Formato: Artigo
Idioma:Inglês
Publicado em: 2012
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Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3731134/
https://ncbi.nlm.nih.gov/pubmed/22809421
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1142/S0219720012500084
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