Additional file 1 of Binding affinity prediction for protein–ligand complex using deep attention mechanism based on intermolecular interactions
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https://springernature.figshare.com/articles/dataset/Additional_file_1_of_Binding_affinity_prediction_for_protein_ligand_complex_using_deep_attention_mechanism_based_on_intermolecular_interactions/16960214/1
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资源简介：
Additional file 1: Table S1. Comparison results using the validation dataset. Table S2. Comparison results with lowest pairwise-chains TM-score. Table S3. Comparison results with highest pairwise-chains TM-score. Table S4. Comparison results with Tanimoto coefficient. Table S5. PDB IDs list for all complexes in each dataset. Table S6. Structure similarity of the test datasets to the training dataset. Table S7. Parameters and architecture in convolutional layers.
提供机构：
Park, Sanghyun; Choi, Jonghwan; Ahn, Jaegyoon; Seo, Sangmin
创建时间：
2021-11-09
