Accurate prediction of protein tertiary structural changes induced by single-site mutations with equivariant graph neural networks
Sajid Mahmud, Alex Morehead, Jianlin Jack Cheng
This work introduces an equivariant graph neural network to predict tertiary structural changes from single-site mutations, outperforming AlphaFold in mutant structure prediction.
bioRxiv · Oct 3, 2023 · PreprintBioinformatics