https://github.com/kexinhuang12345/DeepPurpose

A Deep Learning Toolkit for DTI, Drug Property, PPI, DDI, Protein Function Prediction (Bioinformatics)
https://github.com/kexinhuang12345/DeepPurpose

bioinformatics covid19 ddi deep-learning drug-discovery drug-drug-interaction drug-property-prediction drug-repurposing drug-target-interaction drug-target-interactions dti-prediction ppi protein-function-prediction protein-protein-interaction qsar repurposing-drugs side-effects toolkit virtual-screening

Last synced: about 1 month ago
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A Deep Learning Toolkit for DTI, Drug Property, PPI, DDI, Protein Function Prediction (Bioinformatics)

• Host: GitHub
• URL: https://github.com/kexinhuang12345/DeepPurpose
• Owner: kexinhuang12345
• License: bsd-3-clause
• Created: 2020-03-19T00:32:38.000Z (over 4 years ago)
• Default Branch: master
• Last Pushed: 2024-06-10T00:41:46.000Z (6 months ago)
• Last Synced: 2024-10-01T20:41:04.252Z (2 months ago)
• Topics: bioinformatics, covid19, ddi, deep-learning, drug-discovery, drug-drug-interaction, drug-property-prediction, drug-repurposing, drug-target-interaction, drug-target-interactions, dti-prediction, ppi, protein-function-prediction, protein-protein-interaction, qsar, repurposing-drugs, side-effects, toolkit, virtual-screening
• Language: Jupyter Notebook
• Homepage: https://doi.org/10.1093/bioinformatics/btaa1005
• Size: 14.5 MB
• Stars: 961
• Watchers: 31
• Forks: 273
• Open Issues: 17
• Metadata Files:
  • Readme: README.md
  • License: LICENSE.md

Awesome Lists containing this project

• awesome-biochem-ai - DeepPurpose
• StarryDivineSky - kexinhuang12345/DeepPurpose - 靶标相互作用（Drug-Target Interaction）预测的模型。DTI预测是新药研发中的一项基本任务。DeepPurpose的操作模式是像scikit-learn一样。只需几行代码，就可以利用最前沿的深度学习和药物研发模型。DeepPurpose还有一个简单的界面来做DTI预测的两个重要应用：虚拟筛选（Virtual Screening）和旧药新用（Drug Repurposing）。 (药物-靶标 药物-药物 化合物-蛋白质 相互作用 / 网络服务_其他)