Drug Target Interaction

DeepPurposeJupyter Notebook

A deep learning library for drug-target interaction, drug property, protein-protein interaction, drug-drug interaction, and protein function prediction in bioinformatics.

MolTransJupyter Notebook

A transformer-based model for predicting drug-target interactions using substructural pattern mining and augmented transformer encoders.

DTINetMATLAB

A computational pipeline that predicts drug-target interactions by learning low-dimensional vector representations from heterogeneous biological networks.