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Distance-Based Configurational Entropy of Proteins from Molecular Dynamics Simulations
Estimation of configurational entropy from molecular dynamics trajectories is a difficult task which is often performed using quasi-harmonic or histogram analysis. An entirely different approach, proposed recently, estimates local density distribution around each conformational sample by measuring t...
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| 出版年: | PLoS One |
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| 主要な著者: | , , , , , , , , |
| フォーマット: | Artigo |
| 言語: | Inglês |
| 出版事項: |
Public Library of Science
2015
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| 主題: | |
| オンライン･アクセス: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4503633/ https://ncbi.nlm.nih.gov/pubmed/26177039 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1371/journal.pone.0132356 |
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