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Protein Backbone Strurcture Prediction based on deeplearning

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DeepPBS

Motivation: Accurate all-atom protein structures play an important role in various research and applications. However, in most cases, only coarse-grained models can be obtained for reasons. Precisely predict protein backbone structures based on alpha-carbon traces, the most-used coarse-grained model, is a pivotal step for precise all-atom modeling for protein structures.

Results: In this study, we proposed a deep learning-based method to predict protein backbone structures from alpha-carbon traces. Our method achieved comparable performance as the best previous method with cRMSD between predicted coordinates and reference coordinates as measurement.

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  • Python / Pytorch / Django
  • KNN / Bi-litsm / Rodrigues

Protein structure prediction process

Protein backbone strcture prediction

deeppbs

Method of rotation repetition

rotation

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Protein Backbone Strurcture Prediction based on deeplearning

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  • Python 80.4%
  • Jupyter Notebook 19.6%