bpmunson / polygon

POLYGON VAE For de novo Polypharmacology
MIT License
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Train Ligand Binding Models for Two Protein Targets #10

Open DM0815 opened 3 months ago

DM0815 commented 3 months ago

Train Ligand Binding Models for Two Protein Targets When applied this function, I used the protein (uniprot_id) I wanted to research. But it cannot generate a pkl file. I would like to know if the reason for this is because this database file doesn't have the ligand data for the protein I want to study that is strongly related?