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Incorporation of Phylogenetic and Comparative Genomic Information in Deep Neural Network for RNA Secondary Structure Prediction

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Xu, Jiajia

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In RNA secondary structure prediction, deep neural network (DNN) models have become mainstream and achieved State-Of-The-Art performance. Biological prior information such as hard constraints on RNA structure, including Watson-Crick base pairing and minimum loop length, have been included in these neural network architectures to further promote prediction accuracy. However, comparative genomic information from species evolution has never been incorporated into such models. In conserving RNA structure across evolutionary time, the proportion of compensatory double substitutions & compatible single substitutions in base-pairing region is expected to be higher than that in unpaired regions (e.g. loops or bulges in secondary structure). We hypothesize that incorporating this evolutionary signal can better differentiate base-pairs and loops, to improve the accuracy of secondary structure prediction. In this thesis, we propose a new approach of extracting and encoding these characteristic substitution patterns in a DNN architecture to improve RNA secondary structure prediction accuracy. I show that the proposed approach substantially improves prediction performance on both synthetic and real-world RNA sequences.

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