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. 2023 Sep 20;63(19):6053–6067. doi: 10.1021/acs.jcim.3c00422

Figure 5.

Figure 5

Overview of the main object-detection model. An input image containing the full reaction scheme is fed through a convolutional feature extractor (ResNeXt101), and the output feature maps are then passed to a Region Proposal Network, where regions of interest are selected and regressed. After being passed through fully connected layers, the learned class-specific information is used to classify and further regress bounding boxes to output image patches containing chemical diagrams, chemical labels, and arrow annotations.