Deep learning-based dipeptidyl peptidase IV inhibitor screening, experimental validation, and GaMD/LiGaMD analysis
Our study offers a robust approach and valuable insights for the development of DPP4 inhibitors, providing an effective means to investigate the binding and dissociation mechanisms between proteins and compounds.
Authors
- Weiwei Han (ORCID: https://orcid.org/0000-0002-1931-9316)
- Yi He (ORCID: https://orcid.org/0000-0002-6884-5312)
- Wannan Li (ORCID: https://orcid.org/0000-0001-6983-4343)
- Jiaying Li (ORCID: https://orcid.org/0000-0002-1946-6156)
- Yan Zhang (ORCID: https://orcid.org/0000-0003-3374-0868)
- Minghao Liu (ORCID: https://orcid.org/0000-0003-1235-5127)
Institutions
- Ministry of Education (KN)
Publication Details
- Journal
- BMC Biology
- Published
- 2025-07-01
- DOI
- https://doi.org/10.1186/s12915-025-02295-8
- Citations
- 2
- Primary Topic
- Peptidase Inhibition and Analysis
- Type
- article
- Field-Weighted Citation Impact
- 2.09
Funders
- Jilin University