Protein vibrational frequencies dataset: Rapid Prediction of Protein Natural Frequencies using Graph Neural Networks
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https://zenodo.org/record/6346660
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资源简介：
Dataset for machine learning model, based on graph neural network, to predict protein natural frequencies using Graph Neural Networks.
Code: https://github.com/lamm-mit/ProteinMechanicsGNN
Paper:
Rapid Prediction of Protein Natural Frequencies using Graph Neural Networks
Kai Guo and Markus J. Buehler
Digital Discovery, 2022, DOI: 10.1039/D1DD00007A
创建时间：
2022-04-01
