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Transformer-Based Molecular Generative Model for Antiviral Drug Design.
Jiashun Mao
Jianmin Wang
Amir Zeb
Kwang-Hwi Cho
Haiyan Jin
Jongwan Kim
Onju Lee
Yunyun Wang
Kyoung Tai No
Published in:
J. Chem. Inf. Model. (2024)
Keyphrases
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generative model
drug design
quantitative structure activity
drug discovery
probabilistic model
protein structure prediction
protein protein interactions
prior knowledge
em algorithm
latent dirichlet allocation
semi supervised
expectation maximization
training data
topic models
graph theory