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Generative models for molecular discovery: Recent advances and challenges
WIREs Computational Molecular Science, 2022Development of new products often relies on the discovery of novel molecules. While conventional molecular design involves using human expertise to propose, synthesize, and test new molecules, this process can be cost and time intensive, limiting the ...
Camille L. Bilodeau +4 more
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Molecular design in drug discovery: a comprehensive review of deep generative models
Briefings Bioinform., 2021Deep generative models have been an upsurge in the deep learning community since they were proposed. These models are designed for generating new synthetic data including images, videos and texts by fitting the data approximate distributions. In the last
Yu Cheng +4 more
semanticscholar +1 more source