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Random forest (RF), support-vector machine (SVM), and deep neural network (DNN) models for predicting kinase inhibitors with different binding modes in X-ray structures are made available together with the data sets used for training and testing. Please refer to READ_ME.txt for more information.
protein kinases, machine learning, classification models, kinase inhibitors, inhibitor binding modes, X-ray data
protein kinases, machine learning, classification models, kinase inhibitors, inhibitor binding modes, X-ray data
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