NSCLC-GDTI: Integrating graph convolution networks for drug target interaction screening in non-small cell lung cancer
If you use the data or code of this research, kindly cite:
Margaretha, F., Sari, A.N., Rasyak, M.R., Parikesit, A.A. (2024). Integrating graph convolutional networks for drug-target interaction screening in non-small cell lung cancer.
Candidate drugs for NSCLC: NSCLCGDTI>Result>candidatedrugs.csv
- Prepare environment and install packages
- For environment, you can use conda or python environment
- After activating your environment, install the necessary packages from requirements.txt
cd NSCLCGDTI
pip install -r requirements.txt
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Use the pre-trained model in model folder
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For training code refer to main.py