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Rapid ab initio prediction of RNA pseudoknots via graph tree decomposition (2008)

by J Zhao
Venue:J. Math. Biol
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TT2NE: a novel algorithm to predict RNA secondary structures with pseudoknots

by Henri Orl - Nucleic Acids Res , 2011
"... We present TT2NE, a new algorithm to predict RNA secondary structures with pseudoknots. The method is based on a classification of RNA struc-tures according to their topological genus. TT2NE is guaranteed to find the minimum free energy structure regardless of pseudoknot topology. This unique profic ..."
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We present TT2NE, a new algorithm to predict RNA secondary structures with pseudoknots. The method is based on a classification of RNA struc-tures according to their topological genus. TT2NE is guaranteed to find the minimum free energy structure regardless of pseudoknot topology. This unique proficiency is obtained at the expense of the maximum length of sequences that can be treated, but comparison with state-of-the-art algo-rithms shows that TT2NE significantly improves the quality of predictions. Analysis of TT2NE’s incorrect predictions sheds light on the need to study how sterical constraints limit the range of pseudoknotted structures that can be formed from a given sequence. An implementation of TT2NE on a public server can be found at
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...esearch, 2011, Vol. 39, No. 14 PAGE 2 OF 8 on a restricted class of pseudoknots (15–17) and (iii) exact calculations, using various tricks to allow for the treatment of sequences as large as possible =-=(18)-=-. Here we present TT2NE, an algorithm that falls into the latter category. TT2NE relies on the ‘maximum weighted independent set’ (WIS) formalism. In this formalism, an RNA structure is viewed as an a...

New Width Parameters of Graphs

by Martin Vatshelle , 2012
"... The main focus of this thesis is on using the divide and conquer technique to efficiently solve graph problems that are in general intractable. We work in the field of parameterized algorithms, using width parameters of graphs that indicate the complexity inherent in the structure of the input graph ..."
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The main focus of this thesis is on using the divide and conquer technique to efficiently solve graph problems that are in general intractable. We work in the field of parameterized algorithms, using width parameters of graphs that indicate the complexity inherent in the structure of the input graph. We use the notion of branch decompositions of a set function introduced by Robert-son and Seymour to define three new graph parameters, boolean-width, max-imum matching-width (MM-width) and maximum induced matching-width (MIM-width). We compare these new graph width parameters to existing graph parameters by defining partial orders of width parameters. We focus on tree-width, branch-width, clique-width, module-width and rank-width, and include a Hasse diagram of these orders containing 32 graph parameters. We use the size of a maximum matching in a bipartite graph as a set function to define MM-width and show that MM-width never differs by more than a multiplicative factor 3 from tree-width. The main reason for introduc-
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...w of standard graph terminology. For a more complete introduction to graph theory there are many good books for example an introductory book by R. J. Wilson [77] or a more advanced book by R. Diestel =-=[22]-=-. Graph A graph G is a pair V (G) called the vertices, and E(G) called the edges where edges are unordered pairs of the vertices. We will only consider loopless simple undirected graphs in this thesis...

doi:10.1093/bioinformatics/btq218 Thermodynamics of RNA structures by Wang–Landau sampling

by Feng Lou, Peter Clote
"... Vol. 26 ISMB 2010, pages i278–i286 ..."
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Vol. 26 ISMB 2010, pages i278–i286

The Extragalactic Reference

by Lanza Ga, Pitocco D, Navarese Ep, Sestito A, Sgueglia Ga, Manto A, Infusino F, Musella T, Crea F. Association Between, Gaetano A. Lanza - International Celestial Reference , 1995
"... observed in the atenolol group could be related to more favourable changes in con-founding factors, as compared with the control group. Interestingly, although we did not assess triglyceride levels (a poten-tially modifiable confounding variable) at follow-up, the latter might be expected to increas ..."
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observed in the atenolol group could be related to more favourable changes in con-founding factors, as compared with the control group. Interestingly, although we did not assess triglyceride levels (a poten-tially modifiable confounding variable) at follow-up, the latter might be expected to increase only in the beta-blockade group2, which, in contrast with Yildiz et al.’s fears, might have limited the favourable auto-nomic mediated effect on CRP serum levels shown in atenolol treated patients.

On the Page Number of Secondary Structures with Pseudoknots

by Peter Clote, Stefan Dobrev, Ivan Dotu, Evangelos Kranakis, Danny Krizanc, Jorge Urrutia , 2011
"... Let S denote the set of (possibly noncanonical) base pairs {i, j} of an RNA tertiary structure; i.e. {i, j} ∈ S if there is a hydrogen bond between the ith and jth nucleotide. The page number of S, denoted π(S), is the minimum number k such that S can be decomposed into a disjoint union of k second ..."
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Let S denote the set of (possibly noncanonical) base pairs {i, j} of an RNA tertiary structure; i.e. {i, j} ∈ S if there is a hydrogen bond between the ith and jth nucleotide. The page number of S, denoted π(S), is the minimum number k such that S can be decomposed into a disjoint union of k secondary structures. Here, we show that computing the page number is NP-complete; we describe an exact computation of page number, using constraint programming, and determine the page number of a collection of RNA tertiary structures, for which the topological genus is known. We describe two greedy algorithms, and show by an example that neither is optimal. We describe an algorithm running in time O(n log n) that produces a decomposition of an RNA structure S on n bases into at most ω(S)·log n disjoint secondary structures, where ω(S) denotes the maximum number of base pairs that may cross a given base pair. It follows that ω(S) ≤ π(S) ≤ ω(S) · log n, where π(S) denotes the page number of S. We give an O(n 3/2) time algorithm for finding a 2-page decomposition of bisecondary structures for RNA sequences of size n, and we provide bounds on the expected page number of random structures having pseudoknots.

3Institute of Structural

by Keren Lasker, Maya Topf, Andrej Sali, Haim J. Wolfson, Department Of Bioengineering, Molecular Biology , 2009
"... Available online ..."
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Available online

OF PROCESSES

by Andrej Sali
"... Proteomics techniques have been used to generate com-prehensive lists of protein interactions in a number of species. However, relatively little is known about how these interactions result in functional multiprotein com-plexes. This gap can be bridged by combining data from proteomics experiments w ..."
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Proteomics techniques have been used to generate com-prehensive lists of protein interactions in a number of species. However, relatively little is known about how these interactions result in functional multiprotein com-plexes. This gap can be bridged by combining data from proteomics experiments with data from established structure determination techniques. Correspondingly, in-tegrative computational methods are being developed to provide descriptions of protein complexes at varying lev-els of accuracy and resolution, ranging from complex compositions to detailed atomic structures. Molecular & Cellular Proteomics 9:1689–1702, 2010. A 3-D enhanced version of this article is available. The text is identical to this version but includes interactive figures. Viewing the enhanced version of this article requires the use of a browser plug-in. Please install the plug-in when prompted.
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...the number of components in the largest subset. Similar ideas have been used for various modeling tasks such as side chain packing (102–104), sequence-structure threading (103), ab initio RNA folding =-=(105)-=-, and prediction of quaternary structures of multiprotein complexes (106). Molecular Architecture from Proteomics Molecular & Cellular Proteomics 9.8 1695 Use of Restraints to Restrain the Search Spac...

Impact Of The Energy Model On The Complexity Of RNA Folding With Pseudoknots

by Saad Sheikha, Rolf Backofenb, Yann Pontyc
"... Abstract. Predicting the folding of an RNA sequence, while allow-ing general pseudoknots (PK), consists in finding a minimal free-energy matching of its n positions. Assuming independently contributing base-pairs, the problem can be solved in Θ(n3)-time using a variant of the maximal weighted matchi ..."
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Abstract. Predicting the folding of an RNA sequence, while allow-ing general pseudoknots (PK), consists in finding a minimal free-energy matching of its n positions. Assuming independently contributing base-pairs, the problem can be solved in Θ(n3)-time using a variant of the maximal weighted matching. By contrast, the problem was previously proven NP-Hard in the more realistic nearest-neighbor energy model. In this work, we consider an intermediate model, called the stacking-pairs energy model. We extend a result by Lyngsø, showing that RNA folding with PK is NP-Hard within a large class of parametrization for the model. We also show the approximability of the problem, by giving a practical Θ(n3) algorithm that achieves at least a 5-approximation for any parametrization of the stacking model. This contrasts nicely with the nearest-neighbor version of the problem, which we prove cannot be approximated within any positive ratio, unless P = NP.
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...arestneighbor energy model was independently established by Lyngsø and Pedersen [12], and Akutsu [1]. Subsequent efforts have therefore focused on providing either parameterized complexity algorithms =-=[11, 20]-=-, heuristics [4, 18] or exact DP schemes for tractable subsets of pseudoknots [16, 15]. ha l-0 06 70 23 2,sv er sio ns3s- 1 5sNo vs20 12 It is frequent that the complexity of solving any problem in co...

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