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Protein-Protein Docking Using EMAP in CHARMM and Support Vector Machine: Application to Ab/Ag Complexes

In this work, we have (i) evaluated the ability of the EMAP method implemented in the CHARMM program to generate the correct conformation of Ab/Ag complex structures and (ii) developed a support vector machine (SVM) classifier to detect native conformations among the thousands of refined Ab/Ag confi...

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Detalhes bibliográficos
Publicado no:J Chem Theory Comput
Main Authors: Wright, Jon D., Sargsyan, Karen, Wu, Xiongwu, Brooks, Bernard R., Lim, Carmay
Formato: Artigo
Idioma:Inglês
Publicado em: 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6415758/
https://ncbi.nlm.nih.gov/pubmed/26592408
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct400508s
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