PepGB: Facilitating peptide drug discovery via graph neural networks.

Yipin Lei Xu Wang Meng Fang Han Li Xiang Li Jianyang Zeng

Published in: CoRR (2024)

Keyphrases

drug discovery
neural network
mass spectrometry
chemical compounds
pharmaceutical industry
random walk
structured data
early stage
systems biology
scientific data
virtual screening
graph data
biological systems
weighted graph
data mining
high dimensional data
knn
real world