A novel virtual drug screening pipeline with deep-leaning as core component identifies inhibitor of pancreatic alpha-amylase.
Haiping ZhangTingting ZhangKonda Mani SaravananLinbu LiaoHao WuHaishan ZhangHuiling ZhangYi PanXuli WuYanjie WeiPublished in: BIBM (2021)
Keyphrases
- core components
- drug discovery
- virtual world
- virtual environment
- open source
- web services
- virtual reality
- human immunodeficiency virus
- deep learning
- database
- diabetes mellitus
- augmented reality
- chemical compounds
- early stage
- distributed digital library
- pipeline architecture
- belief nets
- image analysis
- data sets
- real time