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Fast Approximations of the Rotational Diffusion Tensor and their Application to Structural Assembly of Molecular Complexes

We present and evaluate a rigid-body, deterministic, molecular docking method, called ELMDOCK, that relies solely on the three-dimensional structure of the individual components and the overall rotational diffusion tensor of the complex, obtained from nuclear spin-relaxation measurements. We also in...

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書誌詳細
主要な著者: Berlin, Konstantin, O’Leary, Dianne P., Fushman, David
フォーマット: Artigo
言語:Inglês
出版事項: 2011
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC3115445/
https://ncbi.nlm.nih.gov/pubmed/21604302
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/prot.23053
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