Integrated Machine Learning and Molecular Simulation-Guided Discovery of Novel Small-Molecule PD-L1 Inhibitors

Mengjie Rui, Wenyan Liang, Kexin Chu, Jiukun Yuan, Ruojing Yang, Hangyu Dong, Chunlai Feng

Open source

DOI
10.3390/ph19091439
Published
2026-09-11
Container
Pharmaceuticals
Publisher
MDPI AG
Open access
unknown

Credibility signals

uncertain Score 64/100 under policy 1.0.0. This is a metadata assessment, not a judgment of the paper's conclusions.

Show all credibility signals

Cite this work

BibTeX

@article{allodium:10.3390/ph19091439,
  title = {Integrated Machine Learning and Molecular Simulation-Guided Discovery of Novel Small-Molecule PD-L1 Inhibitors},
  author = {Mengjie Rui and Wenyan Liang and Kexin Chu and Jiukun Yuan and Ruojing Yang and Hangyu Dong and Chunlai Feng},
  year = {2026},
  journal = {Pharmaceuticals},
  doi = {10.3390/ph19091439},
  url = {https://doi.org/10.3390/ph19091439}
}

RIS

TY  - JOUR
TI  - Integrated Machine Learning and Molecular Simulation-Guided Discovery of Novel Small-Molecule PD-L1 Inhibitors
AU  - Mengjie Rui
AU  - Wenyan Liang
AU  - Kexin Chu
AU  - Jiukun Yuan
AU  - Ruojing Yang
AU  - Hangyu Dong
AU  - Chunlai Feng
PY  - 2026
JO  - Pharmaceuticals
DO  - 10.3390/ph19091439
UR  - https://doi.org/10.3390/ph19091439
ER  - 

APA

Rui, M., Liang, W., Chu, K., Yuan, J., Yang, R., Dong, H., & Feng, C. (2026). Integrated Machine Learning and Molecular Simulation-Guided Discovery of Novel Small-Molecule PD-L1 Inhibitors. Pharmaceuticals. https://doi.org/10.3390/ph19091439

Source records