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10.1007/s41048-015-0001-4

http://scihub22266oqcxt.onion/10.1007/s41048-015-0001-4
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C4762127!4762127 !26942214
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suck abstract from ncbi


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pmid26942214
      Biophys+Rep 2015 ; 1 (ä): 2-13
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  • Physics-based RNA structure prediction #MMPMID26942214
  • Xu X ; Chen SJ
  • Biophys Rep 2015[]; 1 (ä): 2-13 PMID26942214 show ga
  • Despite the success of RNA secondary structure prediction for simple, short RNAs, the problem of predicting RNAs with long-range tertiary folds remains. Furthermore, RNA 3D structure prediction is hampered by the lack of the knowledge about the tertiary contacts and their thermodynamic parameters. Low-resolution structural modeling enables us to estimate the conformational entropies for a number of tertiary folds through rigorous statistical mechanical calculations. The models lead to 3D tertiary folds at coarse-grained level. The coarse-grained structures serve as the initial structures for all-atom molecular dynamics refinement to build the final all-atom 3D structures. In this paper, we present an overview of RNA computational models for secondary and tertiary structures' predictions and then focus on a recently developed RNA statistical mechanical model-the Vfold model. The main emphasis is placed on the physics behind the models, including the treatment of the non-canonical interactions in secondary and tertiary structure modelings, and the correlations to RNA functions.
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