Here, we introduce DDI-GCN, a method that utilizes graph convolutional networks (GCN) to predict DDIs based on chemical structures. We demonstrate that this method achieves state-of-the-art prediction performance on the independent hold-out set. It can also provide visualization of structural ...
To alleviate this problem, we investigate the utilization of the end-to-end graph representation learning for the DDI prediction task. We establish a novel DDI prediction method named GCN-BMP (Graph Convolutional Network wth Bond-aware Message Propagation) to conduct the accurate prediction for DD...
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To alleviate this problem, we investigate the utilization of the end-to-end graph representation learning for the DDI prediction task. We establish a novel DDI prediction method named GCN-BMP (Graph Convolutional Network with Bond-aware Message Propagation) to conduct an accurate prediction for DD...