Training and test datasets used for building graph convolutional deep neural network model for prediction molecular electrostatic surfaces
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下载链接：
https://figshare.com/articles/Training_and_test_datasets_used_for_building_graph_convolutional_deep_neural_network_model_for_prediction_molecular_electrostatic_surfaces/9768071/1
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资源简介：
The model build using these datasets can be found at https://github.com/AstexUK/ESP_DNN/tree/master/esp_dnn<br>The dataset themselves can be opened using xarray Python library (http://xarray.pydata.org/en/stable/#)
提供机构：
figshare
创建时间：
2019-09-05
