OnionNet-2 is constructed based on convolutional neural network (CNN) to predict the protein-ligand binding affinity.
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Mar 2, 2024 - Python
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protein-ligand-complexes
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PDB-CAT aims to automatically categorize the mmCIF PDB structures based on the type of interaction between atoms in the protein and the ligand, and checking for any mutations in the sequence.
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Updated
Jan 21, 2026 - Jupyter Notebook
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