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. 2024 Feb 13;29(4):832. doi: 10.3390/molecules29040832

Figure 5.

Figure 5

Illustration of distance-based protein structure prediction methods. Starting from a query sequence, an MSA is first generated by searching through databases. Then, the MSA is fed into deep neural networks to predict spatial restraints, such as distance maps, inter-residue orientations, and hydrogen bond networks. Finally, the final structural model is constructed by employing the potentials extracted from the predicted spatial restraints in a folding simulation to identify the lowest energy structure.