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DEEPScreen cansyl
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DEEPScreen: Virtual Screening with Deep Convolutional Neural Networks Using Compound Images
deep-learning bioinformatics drug-discovery cheminformatics drug-repurposing machine-learning prediction-model command-line-tool 2d-images-of-compounds performance-evaluation drug-target-interactions hyper-parameter-optimization convolutional-neural-networks
Created 2019-01-09
62 commits to pytorch branch, last one 6 months ago